methyl 2-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(3-bromo-4,5-dimethoxy-phenyl)prop-2-enoylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[3-(3-bromo-4,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(3-bromo-4,5-dimethoxyphenyl)prop-2-enoylamino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[[3-(3-bromo-4,5-dimethoxy-phenyl)acryloyl]amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C26H26BrNO6S MolecularWeight: 560.45674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C=CC3=CC(=C(C(=C3)Br)OC)OC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C=CC3=CC(=C(C(=C3)Br)OC)OC)C

InChI

InChI=1S/C26H26BrNO6S/c1-6-34-18-10-8-17(9-11-18)22-15(2)35-25(23(22)26(30)33-5)28-21(29)12-7-16-13-19(27)24(32-4)20(14-16)31-3/h7-14H,6H2,1-5H3,(H,28,29)