2-(3,4-dimethylphenyl)sulfanyl-N-[4-(2-methylpropanoylamino)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[4-(2-methylpropanoylamino)phenyl]pyridine-3-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[4-(2-methylpropanoylamino)phenyl]pyridine-3-carboxamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-3-pyridinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[4-(2-methylpropanoylamino)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-[4-(isobutyrylamino)phenyl]nicotinamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C)C

InChI

InChI=1S/C24H25N3O2S/c1-15(2)22(28)26-18-8-10-19(11-9-18)27-23(29)21-6-5-13-25-24(21)30-20-12-7-16(3)17(4)14-20/h5-15H,1-4H3,(H,26,28)(H,27,29)