ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(1H-benzimidazol-2-ylthio)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H22N4O3S/c1-2-24-17(23)21-9-7-12(8-10-21)18-15(22)11-25-16-19-13-5-3-4-6-14(13)20-16/h3-6,12H,2,7-11H2,1H3,(H,18,22)(H,19,20)