methyl 2-[[4-[4-(2-hydroxyethyloxy)-3-iodanyl-5-methoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-[4-(2-hydroxyethyloxy)-3-iodanyl-5-methoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-[4-(2-hydroxyethoxy)-3-iodo-5-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]benzoate CAS Name: 2-[[[4-[4-(2-hydroxyethoxy)-3-iodo-5-methoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-[4-(2-hydroxyethoxy)-3-iodo-5-methoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]benzoate Traditional Name: 2-[[4-[4-(2-hydroxyethoxy)-3-iodo-5-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]benzoic acid methyl ester Formula: C23H24IN3O6S MolecularWeight: 597.42263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)I)OCCO)OC)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)I)OCCO)OC)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C23H24IN3O6S/c1-12-18(21(29)26-16-7-5-4-6-14(16)22(30)32-3)19(27-23(34)25-12)13-10-15(24)20(33-9-8-28)17(11-13)31-2/h4-7,10-11,19,28H,8-9H2,1-3H3,(H,26,29)(H2,25,27,34)