2-(4-methylphenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-(p-tolyl)thiazole-4-carboxamide CAS Name: N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-2-(4-methylphenyl)-4-thiazolecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-2-(p-tolyl)thiazole-4-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

InChI

InChI=1S/C22H23N3O2S/c1-14(2)20(26)24-18-6-4-5-16(11-18)12-23-21(27)19-13-28-22(25-19)17-9-7-15(3)8-10-17/h4-11,13-14H,12H2,1-3H3,(H,23,27)(H,24,26)