[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 3-pyrrol-1-ylthiophene-2-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 3-pyrrol-1-ylthiophene-2-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 3-pyrrol-1-ylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolyl)-2-thiophenecarboxylic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 3-pyrrol-1-ylthiophene-2-carboxylic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H18N2O4S2 MolecularWeight: 426.50862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=CS3)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C=CS3)N4C=CC=C4)OC

InChI

InChI=1S/C21H18N2O4S2/c1-25-17-6-5-14(11-18(17)26-2)20-22-15(13-29-20)12-27-21(24)19-16(7-10-28-19)23-8-3-4-9-23/h3-11,13H,12H2,1-2H3