tert-butyl 4-[2-[2-oxidanylidene-3-[(phenylmethyl)carbamoyl]-1H-benzimidazol-5-yl]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[2-oxidanylidene-3-[(phenylmethyl)carbamoyl]-1H-benzimidazol-5-yl]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[3-(benzylcarbamoyl)-2-oxo-1H-benzimidazol-5-yl]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[2-oxo-3-[oxo-[(phenylmethyl)amino]methyl]-1H-benzimidazol-5-yl]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[3-(benzylcarbamoyl)-2-oxo-1H-benzimidazol-5-yl]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-(benzylcarbamoyl)-2-keto-1H-benzimidazol-5-yl]ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCC2=CC3=C(C=C2)NC(=O)N3C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCC2=CC3=C(C=C2)NC(=O)N3C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H33N5O4/c1-26(2,3)35-25(34)30-15-13-29(14-16-30)12-11-19-9-10-21-22(17-19)31(24(33)28-21)23(32)27-18-20-7-5-4-6-8-20/h4-10,17H,11-16,18H2,1-3H3,(H,27,32)(H,28,33)