(2S)-3-[(4-bromophenyl)amino]-2-cyano-but-3-enamide

Systemtic Name: (2S)-3-[(4-bromophenyl)amino]-2-cyano-but-3-enamide Openeye Name: (2S)-3-(4-bromoanilino)-2-cyano-but-3-enamide CAS Name: (2S)-3-(4-bromoanilino)-2-cyano-3-butenamide IUPAC Name: (2S)-3-(4-bromoanilino)-2-cyanobut-3-enamide Traditional Name: (2S)-3-(4-bromoanilino)-2-cyano-but-3-enamide Formula: C11H10BrN3O MolecularWeight: 280.1206

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)N)NC1=CC=C(C=C1)Br

Isomeric SMILES

C=C([C@@H](C#N)C(=O)N)NC1=CC=C(C=C1)Br

InChI

InChI=1S/C11H10BrN3O/c1-7(10(6-13)11(14)16)15-9-4-2-8(12)3-5-9/h2-5,10,15H,1H2,(H2,14,16)/t10-/m1/s1