2-(3,4-dimethylphenyl)sulfanyl-N-[3-[methyl(methylsulfonyl)amino]propyl]pyridine-3-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[3-[methyl(methylsulfonyl)amino]propyl]pyridine-3-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[3-[methyl(methylsulfonyl)amino]propyl]pyridine-3-carboxamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-[3-[methyl(methylsulfonyl)amino]propyl]-3-pyridinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[3-[methyl(methylsulfonyl)amino]propyl]pyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-[3-[mesyl(methyl)amino]propyl]nicotinamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCN(C)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NCCCN(C)S(=O)(=O)C)C

InChI

InChI=1S/C19H25N3O3S2/c1-14-8-9-16(13-15(14)2)26-19-17(7-5-10-21-19)18(23)20-11-6-12-22(3)27(4,24)25/h5,7-10,13H,6,11-12H2,1-4H3,(H,20,23)