Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 5 results

Search term: KQVQVIRGVQYGAX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4032011

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H29N3O2S2/c1-23(2)10-6-9-22-21(27)24-11-8-15-13-17(25-3)18(26-4)14-16(15)20(24)19-7-5-12-28-19/h5,7,12-14,20H,6,8-11H2,1-4H3,(H,22,27)
C21H29N3O2S2419.6038611900
6304857

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O2S2/c1-23(2)10-6-9-22-21(27)24-11-8-15-13-17(25-3)18(26-4)14-16(15)20(24)19-7-5-12-28-19/h5,7,12-14,20H,6,8-11H2,1-4H3,(H,22,27)/t20-/m0/s1
C21H29N3O2S2419.60392100
6304859

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O2S2/c1-23(2)10-6-9-22-21(27)24-11-8-15-13-17(25-3)18(26-4)14-16(15)20(24)19-7-5-12-28-19/h5,7,12-14,20H,6,8-11H2,1-4H3,(H,22,27)/t20-/m1/s1
C21H29N3O2S2419.60392100
6304858

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O2S2/c1-23(2)10-6-9-22-21(27)24-11-8-15-13-17(25-3)18(26-4)14-16(15)20(24)19-7-5-12-28-19/h5,7,12-14,20H,6,8-11H2,1-4H3,(H,22,27)/p+1/t20-/m1/s1
C21H30N3O2S2420.61131100
6304856

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O2S2/c1-23(2)10-6-9-22-21(27)24-11-8-15-13-17(25-3)18(26-4)14-16(15)20(24)19-7-5-12-28-19/h5,7,12-14,20H,6,8-11H2,1-4H3,(H,22,27)/p+1/t20-/m0/s1
C21H30N3O2S2420.61131100

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