N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-(cyanomethylsulfanyl)benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-(cyanomethylsulfanyl)benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-2-(cyanomethylsulfanyl)benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-(cyanomethylthio)benzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-(cyanomethylsulfanyl)benzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-2-(cyanomethylthio)benzamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC=CC=C2SCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CC=CC=C2SCC#N

InChI

InChI=1S/C18H16BrN3O2S/c1-12-10-13(19)6-7-15(12)22-17(23)11-21-18(24)14-4-2-3-5-16(14)25-9-8-20/h2-7,10H,9,11H2,1H3,(H,21,24)(H,22,23)