(E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide

Systemtic Name: (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide Openeye Name: (E)-3-[2-(3-bromophenyl)thiazol-4-yl]-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: (E)-3-[2-(3-bromophenyl)-4-thiazolyl]-2-cyano-N-cyclopropyl-2-propenamide IUPAC Name: (E)-3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: (E)-3-[2-(3-bromophenyl)thiazol-4-yl]-2-cyano-N-cyclopropyl-acrylamide Formula: C16H12BrN3OS MolecularWeight: 374.25498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(=CC2=CSC(=N2)C3=CC(=CC=C3)Br)C#N

Isomeric SMILES

C1CC1NC(=O)/C(=C/C2=CSC(=N2)C3=CC(=CC=C3)Br)/C#N

InChI

InChI=1S/C16H12BrN3OS/c17-12-3-1-2-10(6-12)16-20-14(9-22-16)7-11(8-18)15(21)19-13-4-5-13/h1-3,6-7,9,13H,4-5H2,(H,19,21)/b11-7+