N-butyl-2-(3,4-dichlorophenyl)-N-methyl-4-[4-(2-sulfanylidenepiperidin-1-yl)piperidin-1-yl]benzamide

Systemtic Name: N-butyl-2-(3,4-dichlorophenyl)-N-methyl-4-[4-(2-sulfanylidenepiperidin-1-yl)piperidin-1-yl]benzamide Openeye Name: N-butyl-2-(3,4-dichlorophenyl)-N-methyl-4-[4-(2-thioxo-1-piperidyl)-1-piperidyl]benzamide CAS Name: N-butyl-2-(3,4-dichlorophenyl)-N-methyl-4-[4-(2-sulfanylidene-1-piperidinyl)-1-piperidinyl]benzamide IUPAC Name: N-butyl-2-(3,4-dichlorophenyl)-N-methyl-4-[4-(2-sulfanylidenepiperidin-1-yl)piperidin-1-yl]benzamide Traditional Name: N-butyl-2-(3,4-dichlorophenyl)-N-methyl-4-[4-(2-thioxopiperidino)piperidino]benzamide Formula: C28H35Cl2N3OS MolecularWeight: 532.568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(C=C(C=C1)N2CCC(CC2)N3CCCCC3=S)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCCCN(C)C(=O)C1=C(C=C(C=C1)N2CCC(CC2)N3CCCCC3=S)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C28H35Cl2N3OS/c1-3-4-14-31(2)28(34)23-10-9-22(19-24(23)20-8-11-25(29)26(30)18-20)32-16-12-21(13-17-32)33-15-6-5-7-27(33)35/h8-11,18-19,21H,3-7,12-17H2,1-2H3