N-butan-2-yl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-(4-fluorophenyl)sulfanyl-benzamide

Systemtic Name: N-butan-2-yl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-(4-fluorophenyl)sulfanyl-benzamide Openeye Name: 5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-(4-fluorophenyl)sulfanyl-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-[(4-fluorophenyl)thio]benzamide IUPAC Name: N-butan-2-yl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-(4-fluorophenyl)sulfanylbenzamide Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-2-[(4-fluorophenyl)thio]-N-sec-butyl-benzamide Formula: C24H31FN2O3S2 MolecularWeight: 478.642943

Click to see the large picture

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=C(C=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C24H31FN2O3S2/c1-5-18(4)26-24(28)22-13-21(32(29,30)27-14-16(2)12-17(3)15-27)10-11-23(22)31-20-8-6-19(25)7-9-20/h6-11,13,16-18H,5,12,14-15H2,1-4H3,(H,26,28)