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

Systemtic Name: 2-methylsulfanyl-3-phenyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]imidazole-4-carboxamide Openeye Name: N-[[4-(isopropylcarbamoylamino)phenyl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: 2-(methylthio)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-3-phenyl-4-imidazolecarboxamide IUPAC Name: 2-methylsulfanyl-3-phenyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]imidazole-4-carboxamide Traditional Name: N-[4-(isopropylcarbamoylamino)benzyl]-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CN=C(N2C3=CC=CC=C3)SC

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CN=C(N2C3=CC=CC=C3)SC

InChI

InChI=1S/C22H25N5O2S/c1-15(2)25-21(29)26-17-11-9-16(10-12-17)13-23-20(28)19-14-24-22(30-3)27(19)18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,23,28)(H2,25,26,29)