4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]benzonitrile CAS Name: 4-[[4-[[2-(4-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazine-1-carbonyl]benzonitrile Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H22N4O2S/c1-29-21-8-6-18(7-9-21)22-25-20(16-30-22)15-26-10-12-27(13-11-26)23(28)19-4-2-17(14-24)3-5-19/h2-9,16H,10-13,15H2,1H3