4-[[4-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-(p-tolyl)thiazole-4-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[2-(4-methylphenyl)-4-thiazolyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[2-(4-methylphenyl)-1,3-thiazole-4-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-(p-tolyl)thiazole-4-carbonyl]piperazino]methyl]benzonitrile Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H22N4OS/c1-17-2-8-20(9-3-17)22-25-21(16-29-22)23(28)27-12-10-26(11-13-27)15-19-6-4-18(14-24)5-7-19/h2-9,16H,10-13,15H2,1H3