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

Systemtic Name: butyl 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylbenzimidazole-1-carboxylate Openeye Name: butyl 2-(2-amino-2-oxo-ethyl)sulfanylbenzimidazole-1-carboxylate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-1-benzimidazolecarboxylic acid butyl ester IUPAC Name: butyl 2-(2-amino-2-oxoethyl)sulfanylbenzimidazole-1-carboxylate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]benzimidazole-1-carboxylic acid butyl ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C2=CC=CC=C2N=C1SCC(=O)N

Isomeric SMILES

CCCCOC(=O)N1C2=CC=CC=C2N=C1SCC(=O)N

InChI

InChI=1S/C14H17N3O3S/c1-2-3-8-20-14(19)17-11-7-5-4-6-10(11)16-13(17)21-9-12(15)18/h4-7H,2-3,8-9H2,1H3,(H2,15,18)