1-[3-(4-methylpiperidin-1-yl)carbonyl-4-methylsulfanyl-phenyl]sulfonylpiperidine-4-carboxamide

Systemtic Name: 1-[3-(4-methylpiperidin-1-yl)carbonyl-4-methylsulfanyl-phenyl]sulfonylpiperidine-4-carboxamide Openeye Name: 1-[3-(4-methylpiperidine-1-carbonyl)-4-methylsulfanyl-phenyl]sulfonylpiperidine-4-carboxamide CAS Name: 1-[3-[(4-methyl-1-piperidinyl)-oxomethyl]-4-(methylthio)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-[3-(4-methylpiperidine-1-carbonyl)-4-methylsulfanylphenyl]sulfonylpiperidine-4-carboxamide Traditional Name: 1-[3-(4-methylpiperidine-1-carbonyl)-4-(methylthio)phenyl]sulfonylisonipecotamide Formula: C20H29N3O4S2 MolecularWeight: 439.59196

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N)SC

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N)SC

InChI

InChI=1S/C20H29N3O4S2/c1-14-5-9-22(10-6-14)20(25)17-13-16(3-4-18(17)28-2)29(26,27)23-11-7-15(8-12-23)19(21)24/h3-4,13-15H,5-12H2,1-2H3,(H2,21,24)