phenyl 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzimidazole-1-carboxylate

Systemtic Name: phenyl 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzimidazole-1-carboxylate Openeye Name: phenyl 2-(2-amino-2-oxo-ethyl)sulfanylbenzimidazole-1-carboxylate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-1-benzimidazolecarboxylic acid phenyl ester IUPAC Name: phenyl 2-(2-amino-2-oxoethyl)sulfanylbenzimidazole-1-carboxylate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]benzimidazole-1-carboxylic acid phenyl ester Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)N2C3=CC=CC=C3N=C2SCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)N2C3=CC=CC=C3N=C2SCC(=O)N

InChI

InChI=1S/C16H13N3O3S/c17-14(20)10-23-15-18-12-8-4-5-9-13(12)19(15)16(21)22-11-6-2-1-3-7-11/h1-9H,10H2,(H2,17,20)