N-(3-chlorophenyl)-4,6-dimethyl-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4,6-dimethyl-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyridine-3-carboxamide Openeye Name: 2-(2-anilino-2-oxo-ethyl)sulfanyl-N-(3-chlorophenyl)-4,6-dimethyl-pyridine-3-carboxamide CAS Name: 2-[(2-anilino-2-oxoethyl)thio]-N-(3-chlorophenyl)-4,6-dimethyl-3-pyridinecarboxamide IUPAC Name: 2-(2-anilino-2-oxoethyl)sulfanyl-N-(3-chlorophenyl)-4,6-dimethylpyridine-3-carboxamide Traditional Name: 2-[(2-anilino-2-keto-ethyl)thio]-N-(3-chlorophenyl)-4,6-dimethyl-nicotinamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)NC2=CC(=CC=C2)Cl)SCC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)NC2=CC(=CC=C2)Cl)SCC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C22H20ClN3O2S/c1-14-11-15(2)24-22(29-13-19(27)25-17-8-4-3-5-9-17)20(14)21(28)26-18-10-6-7-16(23)12-18/h3-12H,13H2,1-2H3,(H,25,27)(H,26,28)