(3-chloranyl-2-methyl-phenyl)-[4-[4-[1-(4-propan-2-ylsulfinylphenyl)ethylidene]piperidin-1-yl]piperidin-1-yl]methanone

Systemtic Name: (3-chloranyl-2-methyl-phenyl)-[4-[4-[1-(4-propan-2-ylsulfinylphenyl)ethylidene]piperidin-1-yl]piperidin-1-yl]methanone Openeye Name: (3-chloro-2-methyl-phenyl)-[4-[4-[1-(4-isopropylsulfinylphenyl)ethylidene]-1-piperidyl]-1-piperidyl]methanone CAS Name: (3-chloro-2-methylphenyl)-[4-[4-[1-(4-propan-2-ylsulfinylphenyl)ethylidene]-1-piperidinyl]-1-piperidinyl]methanone IUPAC Name: (3-chloro-2-methylphenyl)-[4-[4-[1-(4-propan-2-ylsulfinylphenyl)ethylidene]piperidin-1-yl]piperidin-1-yl]methanone Traditional Name: (3-chloro-2-methyl-phenyl)-[4-[4-[1-(4-isopropylsulfinylphenyl)ethylidene]piperidino]piperidino]methanone Formula: C29H37ClN2O2S MolecularWeight: 513.13428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C(=O)N2CCC(CC2)N3CCC(=C(C)C4=CC=C(C=C4)S(=O)C(C)C)CC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)C(=O)N2CCC(CC2)N3CCC(=C(C)C4=CC=C(C=C4)S(=O)C(C)C)CC3

InChI

InChI=1S/C29H37ClN2O2S/c1-20(2)35(34)26-10-8-23(9-11-26)21(3)24-12-16-31(17-13-24)25-14-18-32(19-15-25)29(33)27-6-5-7-28(30)22(27)4/h5-11,20,25H,12-19H2,1-4H3