ethyl 2-[[4-[1-(phenylmethyl)benzimidazol-2-yl]piperazin-1-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[4-[1-(phenylmethyl)benzimidazol-2-yl]piperazin-1-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[4-(1-benzylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]acetate CAS Name: 2-[[oxo-[4-[1-(phenylmethyl)-2-benzimidazolyl]-1-piperazinyl]methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(1-benzylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]acetate Traditional Name: 2-[[4-(1-benzylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]acetic acid ethyl ester Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CNC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O3/c1-2-31-21(29)16-24-23(30)27-14-12-26(13-15-27)22-25-19-10-6-7-11-20(19)28(22)17-18-8-4-3-5-9-18/h3-11H,2,12-17H2,1H3,(H,24,30)