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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=CSC(=N2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=CSC(=N2)CC3=CC=CC=C3

InChI

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