[2-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 2-cyano-3-phenyl-prop-2-enoate

Systemtic Name: [2-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 2-cyano-3-phenyl-prop-2-enoate Openeye Name: [2-[[4-(3-bromophenyl)thiazol-2-yl]amino]-2-oxo-ethyl] 2-cyano-3-phenyl-prop-2-enoate CAS Name: 2-cyano-3-phenyl-2-propenoic acid [2-[[4-(3-bromophenyl)-2-thiazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 2-cyano-3-phenylprop-2-enoate Traditional Name: 2-cyano-3-phenyl-acrylic acid [2-[[4-(3-bromophenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C21H14BrN3O3S MolecularWeight: 468.32316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H14BrN3O3S/c22-17-8-4-7-15(10-17)18-13-29-21(24-18)25-19(26)12-28-20(27)16(11-23)9-14-5-2-1-3-6-14/h1-10,13H,12H2,(H,24,25,26)