ethyl 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonylamino]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]amino]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]amino]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]amino]carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H27N5O4S/c1-2-33-24(32)29-13-11-18(12-14-29)22(31)28-27-21(30)17-9-7-16(8-10-17)15-34-23-25-19-5-3-4-6-20(19)26-23/h3-10,18H,2,11-15H2,1H3,(H,25,26)(H,27,30)(H,28,31)