6-[(2S)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-5-cyano-2-methyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 6-[(2S)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-5-cyano-2-methyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 6-[(1S)-2-(4-bromoanilino)-1-methyl-2-oxo-ethyl]sulfanyl-5-cyano-2-methyl-N-phenyl-pyridine-3-carboxamide CAS Name: 6-[[(2S)-1-(4-bromoanilino)-1-oxopropan-2-yl]thio]-5-cyano-2-methyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 6-[(2S)-1-(4-bromoanilino)-1-oxopropan-2-yl]sulfanyl-5-cyano-2-methyl-N-phenylpyridine-3-carboxamide Traditional Name: 6-[[(1S)-2-(4-bromoanilino)-2-keto-1-methyl-ethyl]thio]-5-cyano-2-methyl-N-phenyl-nicotinamide Formula: C23H19BrN4O2S MolecularWeight: 495.39156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SC(C)C(=O)NC2=CC=C(C=C2)Br)C#N)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C(=N1)S[C@@H](C)C(=O)NC2=CC=C(C=C2)Br)C#N)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H19BrN4O2S/c1-14-20(22(30)28-18-6-4-3-5-7-18)12-16(13-25)23(26-14)31-15(2)21(29)27-19-10-8-17(24)9-11-19/h3-12,15H,1-2H3,(H,27,29)(H,28,30)/t15-/m0/s1