N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H22N4O2S/c1-29-22-24-14-19(26(22)18-8-3-2-4-9-18)21(28)23-13-15-6-5-7-17(12-15)25-20(27)16-10-11-16/h2-9,12,14,16H,10-11,13H2,1H3,(H,23,28)(H,25,27)