4-(3-chlorophenyl)-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(3-chlorophenyl)-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]piperazine-1-carbothioamide Openeye Name: 4-(3-chlorophenyl)-N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]piperazine-1-carbothioamide CAS Name: 4-(3-chlorophenyl)-N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(3-chlorophenyl)-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]piperazine-1-carbothioamide Traditional Name: 4-(3-chlorophenyl)-N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]piperazine-1-carbothioamide Formula: C24H31ClN4O2S2 MolecularWeight: 507.11154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C24H31ClN4O2S2/c1-18-5-3-6-19(2)29(18)33(30,31)23-11-9-21(10-12-23)26-24(32)28-15-13-27(14-16-28)22-8-4-7-20(25)17-22/h4,7-12,17-19H,3,5-6,13-16H2,1-2H3,(H,26,32)