ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-iodanylphenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-iodanylphenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-iodobenzoyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[(2-iodophenyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-iodobenzoyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[(2-iodobenzoyl)amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H22INO5S MolecularWeight: 551.39395

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C23H22INO5S/c1-5-30-23(27)20-19(14-10-11-17(28-3)18(12-14)29-4)13(2)31-22(20)25-21(26)15-8-6-7-9-16(15)24/h6-12H,5H2,1-4H3,(H,25,26)