N-[(4-cyanophenyl)carbamoyl]-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[(4-cyanophenyl)carbamoyl]-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[(4-cyanophenyl)carbamoyl]acetamide CAS Name: N-[(4-cyanoanilino)-oxomethyl]-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]acetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[(4-cyanophenyl)carbamoyl]acetamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-[(4-cyanophenyl)carbamoyl]acetamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)NC(=O)NC2=CC=C(C=C2)C#N)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NC(=O)NC2=CC=C(C=C2)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C21H19N5O2S/c1-14-18(11-15-5-3-2-4-6-15)25-21(23-14)29-13-19(27)26-20(28)24-17-9-7-16(12-22)8-10-17/h2-10H,11,13H2,1H3,(H,23,25)(H2,24,26,27,28)