2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide

Systemtic Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)propionamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SC(C)C(=O)NC2=CC3=C(C=C2)NC(=O)N3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N1)SC(C)C(=O)NC2=CC3=C(C=C2)NC(=O)N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S/c1-12-17(10-14-6-4-3-5-7-14)26-21(22-12)29-13(2)19(27)23-15-8-9-16-18(11-15)25-20(28)24-16/h3-9,11,13H,10H2,1-2H3,(H,22,26)(H,23,27)(H2,24,25,28)