N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-(2-methylsulfanylimidazol-1-yl)benzamide

Systemtic Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-(2-methylsulfanylimidazol-1-yl)benzamide Openeye Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-(2-methylsulfanylimidazol-1-yl)benzamide CAS Name: N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-4-[2-(methylthio)-1-imidazolyl]benzamide IUPAC Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-(2-methylsulfanylimidazol-1-yl)benzamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-4-[2-(methylthio)imidazol-1-yl]benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)N3C=CN=C3SC

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)N3C=CN=C3SC

InChI

InChI=1S/C22H24N4O2S/c1-15(2)20(27)25-18-6-4-5-16(13-18)14-24-21(28)17-7-9-19(10-8-17)26-12-11-23-22(26)29-3/h4-13,15H,14H2,1-3H3,(H,24,28)(H,25,27)