dimethyl 2-[[2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-cyano-2-(4-phenylthiazol-2-yl)vinyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-cyano-2-(4-phenyl-2-thiazolyl)ethenyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-cyano-2-(4-phenylthiazol-2-yl)vinyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H17N3O4S MolecularWeight: 419.45308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C22H17N3O4S/c1-28-21(26)15-8-9-17(22(27)29-2)18(10-15)24-12-16(11-23)20-25-19(13-30-20)14-6-4-3-5-7-14/h3-10,12-13,24H,1-2H3