N-[(phenylmethyl)carbamoyl]-3-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-[(phenylmethyl)carbamoyl]-3-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(benzylcarbamoyl)-3-(1-benzylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-[oxo-[(phenylmethyl)amino]methyl]-3-[[1-(phenylmethyl)-2-imidazolyl]thio]propanamide IUPAC Name: N-(benzylcarbamoyl)-3-(1-benzylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(benzylcarbamoyl)-3-[(1-benzylimidazol-2-yl)thio]propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC(=O)CCSC2=NC=CN2CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC(=O)CCSC2=NC=CN2CC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c26-19(24-20(27)23-15-17-7-3-1-4-8-17)11-14-28-21-22-12-13-25(21)16-18-9-5-2-6-10-18/h1-10,12-13H,11,14-16H2,(H2,23,24,26,27)