N-[4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-[4-[4-(4-fluorobenzoyl)piperazin-1-yl]phenyl]-2-[4-(p-tolyl)thiazol-2-yl]sulfanyl-acetamide CAS Name: N-[4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-[[4-(4-methylphenyl)-2-thiazolyl]thio]acetamide IUPAC Name: N-[4-[4-(4-fluorobenzoyl)piperazin-1-yl]phenyl]-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide Traditional Name: N-[4-[4-(4-fluorobenzoyl)piperazino]phenyl]-2-[[4-(p-tolyl)thiazol-2-yl]thio]acetamide Formula: C29H27FN4O2S2 MolecularWeight: 546.678683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H27FN4O2S2/c1-20-2-4-21(5-3-20)26-18-37-29(32-26)38-19-27(35)31-24-10-12-25(13-11-24)33-14-16-34(17-15-33)28(36)22-6-8-23(30)9-7-22/h2-13,18H,14-17,19H2,1H3,(H,31,35)