methyl 4-(4-ethoxyphenyl)-2-[(2-iodanylphenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-2-[(2-iodanylphenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethoxyphenyl)-2-[(2-iodobenzoyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[[(2-iodophenyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-2-[(2-iodobenzoyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-iodobenzoyl)amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C22H20INO4S MolecularWeight: 521.36797

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC=CC=C3I)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC=CC=C3I)C

InChI

InChI=1S/C22H20INO4S/c1-4-28-15-11-9-14(10-12-15)18-13(2)29-21(19(18)22(26)27-3)24-20(25)16-7-5-6-8-17(16)23/h5-12H,4H2,1-3H3,(H,24,25)