N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]-4-methyl-benzamide

Systemtic Name: N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]-4-methyl-benzamide Openeye Name: N-[2-(cyanomethyl)-4-(p-tolyl)thiazol-5-yl]-4-methyl-benzamide CAS Name: N-[2-(cyanomethyl)-4-(4-methylphenyl)-5-thiazolyl]-4-methylbenzamide IUPAC Name: N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]-4-methylbenzamide Traditional Name: N-[2-(cyanomethyl)-4-(p-tolyl)thiazol-5-yl]-4-methyl-benzamide Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)CC#N)NC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)CC#N)NC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H17N3OS/c1-13-3-7-15(8-4-13)18-20(25-17(22-18)11-12-21)23-19(24)16-9-5-14(2)6-10-16/h3-10H,11H2,1-2H3,(H,23,24)