N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-(cyanomethylsulfanyl)-N-methyl-benzamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-(cyanomethylsulfanyl)-N-methyl-benzamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-2-(cyanomethylsulfanyl)-N-methyl-benzamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-2-(cyanomethylthio)-N-methylbenzamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-2-(cyanomethylsulfanyl)-N-methylbenzamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-2-(cyanomethylthio)-N-methyl-benzamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C2=CC=CC=C2SCC#N

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C2=CC=CC=C2SCC#N

InChI

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