N-butan-2-yl-2-(3-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-butan-2-yl-2-(3-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: 2-(3-chlorophenyl)sulfanyl-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[(3-chlorophenyl)thio]-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-butan-2-yl-2-(3-chlorophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)sulfonylbenzamide Traditional Name: 2-[(3-chlorophenyl)thio]-5-(3,5-dimethylpiperidino)sulfonyl-N-sec-butyl-benzamide Formula: C24H31ClN2O3S2 MolecularWeight: 495.09754

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CC(CC(C2)C)C)SC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CC(CC(C2)C)C)SC3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H31ClN2O3S2/c1-5-18(4)26-24(28)22-13-21(32(29,30)27-14-16(2)11-17(3)15-27)9-10-23(22)31-20-8-6-7-19(25)12-20/h6-10,12-13,16-18H,5,11,14-15H2,1-4H3,(H,26,28)