4-(2-methylpiperidin-1-yl)sulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Openeye Name: 4-[(2-methyl-1-piperidyl)sulfonyl]-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzamide CAS Name: 4-[(2-methyl-1-piperidinyl)sulfonyl]-N-[4-(3-pyridinylmethylthio)phenyl]benzamide IUPAC Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Traditional Name: 4-(2-methylpiperidino)sulfonyl-N-[4-(3-pyridylmethylthio)phenyl]benzamide Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C25H27N3O3S2/c1-19-5-2-3-16-28(19)33(30,31)24-13-7-21(8-14-24)25(29)27-22-9-11-23(12-10-22)32-18-20-6-4-15-26-17-20/h4,6-15,17,19H,2-3,5,16,18H2,1H3,(H,27,29)