1-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-3-(2-methylphenyl)sulfanyl-propan-1-one

Systemtic Name: 1-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-3-(2-methylphenyl)sulfanyl-propan-1-one Openeye Name: 1-[4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-1-piperidyl]-3-(o-tolylsulfanyl)propan-1-one CAS Name: 1-[4-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-1-piperidinyl]-3-[(2-methylphenyl)thio]-1-propanone IUPAC Name: 1-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-3-(2-methylphenyl)sulfanylpropan-1-one Traditional Name: 1-[4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]piperidino]-3-(o-tolylthio)propan-1-one Formula: C25H27BrN2OS2 MolecularWeight: 515.52868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCCC(=O)N2CCC(CC2)C3=NC(=C(S3)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1SCCC(=O)N2CCC(CC2)C3=NC(=C(S3)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H27BrN2OS2/c1-17-5-3-4-6-22(17)30-16-13-23(29)28-14-11-20(12-15-28)25-27-24(18(2)31-25)19-7-9-21(26)10-8-19/h3-10,20H,11-16H2,1-2H3