propan-2-yl 4-(4-ethoxy-3-iodanyl-5-methoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 4-(4-ethoxy-3-iodanyl-5-methoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-(4-ethoxy-3-iodo-5-methoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-ethoxy-3-iodo-5-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-ethoxy-3-iodo-5-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(4-ethoxy-3-iodo-5-methoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester Formula: C18H23IN2O4S MolecularWeight: 490.35569

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1I)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1I)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C)OC

InChI

InChI=1S/C18H23IN2O4S/c1-6-24-16-12(19)7-11(8-13(16)23-5)15-14(17(22)25-9(2)3)10(4)20-18(26)21-15/h7-9,15H,6H2,1-5H3,(H2,20,21,26)