N-[2-(4-chlorophenyl)ethyl]-4-[1-(4-dimethylaminophenyl)carbonylpiperidin-4-yl]piperidine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-[1-(4-dimethylaminophenyl)carbonylpiperidin-4-yl]piperidine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-[1-[4-(dimethylamino)benzoyl]-4-piperidyl]piperidine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-[1-[(4-dimethylaminophenyl)-oxomethyl]-4-piperidinyl]-1-piperidinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]piperidine-1-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-[1-[4-(dimethylamino)benzoyl]-4-piperidyl]piperidine-1-carbothioamide Formula: C28H37ClN4OS MolecularWeight: 513.13758

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C3CCN(CC3)C(=S)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C3CCN(CC3)C(=S)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H37ClN4OS/c1-31(2)26-9-5-24(6-10-26)27(34)32-17-12-22(13-18-32)23-14-19-33(20-15-23)28(35)30-16-11-21-3-7-25(29)8-4-21/h3-10,22-23H,11-20H2,1-2H3,(H,30,35)