N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]-2-(methylthio)nicotinamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SC)C

InChI

InChI=1S/C20H25N3O3S2/c1-14-11-15(2)13-23(12-14)28(25,26)17-8-6-16(7-9-17)22-19(24)18-5-4-10-21-20(18)27-3/h4-10,14-15H,11-13H2,1-3H3,(H,22,24)