methyl 4-[3-ethoxy-5-iodanyl-4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[3-ethoxy-5-iodanyl-4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-[3-ethoxy-5-iodo-4-[2-(4-methylanilino)-2-oxo-ethoxy]phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[3-ethoxy-5-iodo-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[3-ethoxy-5-iodo-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[3-ethoxy-5-iodo-4-[2-keto-2-(p-toluidino)ethoxy]phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C24H26IN3O5S MolecularWeight: 595.44981

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OC)I)OCC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OC)I)OCC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C24H26IN3O5S/c1-5-32-18-11-15(21-20(23(30)31-4)14(3)26-24(34)28-21)10-17(25)22(18)33-12-19(29)27-16-8-6-13(2)7-9-16/h6-11,21H,5,12H2,1-4H3,(H,27,29)(H2,26,28,34)