4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: 4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-phenyl-thiazole-5-carboxamide CAS Name: 4-methyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-2-phenyl-5-thiazolecarboxamide IUPAC Name: 4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-4-methyl-2-phenyl-thiazole-5-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

InChI

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