2-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 2-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide CAS Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]thio]-4,6-dimethyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(4-bromo-2-methylanilino)-2-oxoethyl]sulfanyl-4,6-dimethyl-N-phenylpyridine-3-carboxamide Traditional Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]thio]-4,6-dimethyl-N-phenyl-nicotinamide Formula: C23H22BrN3O2S MolecularWeight: 484.40868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrN3O2S/c1-14-12-17(24)9-10-19(14)27-20(28)13-30-23-21(15(2)11-16(3)25-23)22(29)26-18-7-5-4-6-8-18/h4-12H,13H2,1-3H3,(H,26,29)(H,27,28)