O4-ethyl O2-(phenylmethyl) 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-(phenylmethyl) 5-[[2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-benzyl 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-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 4-O-ethyl 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-benzyl ester O4-ethyl ester Formula: C26H21N3O4S3 MolecularWeight: 535.65764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC2=CC=CC=C2)NC=C(C#N)C3=NC(=CS3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC2=CC=CC=C2)NC=C(C#N)C3=NC(=CS3)C4=CC=CS4

InChI

InChI=1S/C26H21N3O4S3/c1-3-32-25(30)21-16(2)22(26(31)33-14-17-8-5-4-6-9-17)36-24(21)28-13-18(12-27)23-29-19(15-35-23)20-10-7-11-34-20/h4-11,13,15,28H,3,14H2,1-2H3