O4-ethyl O2-prop-2-enyl 5-[[2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-prop-2-enyl 5-[[2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-allyl O4-ethyl 5-[[2-cyano-2-[4-(2-thienyl)thiazol-2-yl]vinyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-cyano-2-(4-thiophen-2-yl-2-thiazolyl)ethenyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-prop-2-enyl ester IUPAC Name: 4-O-ethyl 2-O-prop-2-enyl 5-[[2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-cyano-2-[4-(2-thienyl)thiazol-2-yl]vinyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-allyl ester O4-ethyl ester Formula: C22H19N3O4S3 MolecularWeight: 485.59896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC=C(C#N)C2=NC(=CS2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC=C(C#N)C2=NC(=CS2)C3=CC=CS3

InChI

InChI=1S/C22H19N3O4S3/c1-4-8-29-22(27)18-13(3)17(21(26)28-5-2)20(32-18)24-11-14(10-23)19-25-15(12-31-19)16-7-6-9-30-16/h4,6-7,9,11-12,24H,1,5,8H2,2-3H3