O2-tert-butyl O4-ethyl 5-[[2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-[[2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-[[2-cyano-2-[4-(p-tolyl)thiazol-2-yl]vinyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-cyano-2-[4-(4-methylphenyl)-2-thiazolyl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-[[2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-cyano-2-[4-(p-tolyl)thiazol-2-yl]vinyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C26H27N3O4S2 MolecularWeight: 509.64028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O4S2/c1-7-32-24(30)20-16(3)21(25(31)33-26(4,5)6)35-23(20)28-13-18(12-27)22-29-19(14-34-22)17-10-8-15(2)9-11-17/h8-11,13-14,28H,7H2,1-6H3