4-(3-ethoxy-5-iodanyl-4-methoxy-phenyl)-N-(4-methylphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(3-ethoxy-5-iodanyl-4-methoxy-phenyl)-N-(4-methylphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(3-ethoxy-5-iodo-4-methoxy-phenyl)-6-phenyl-N-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(3-ethoxy-5-iodo-4-methoxyphenyl)-N-(4-methylphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(3-ethoxy-5-iodo-4-methoxyphenyl)-N-(4-methylphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(3-ethoxy-5-iodo-4-methoxy-phenyl)-6-phenyl-N-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C27H26IN3O3S MolecularWeight: 599.48311

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C)I)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C)I)OC

InChI

InChI=1S/C27H26IN3O3S/c1-4-34-21-15-18(14-20(28)25(21)33-3)24-22(26(32)29-19-12-10-16(2)11-13-19)23(30-27(35)31-24)17-8-6-5-7-9-17/h5-15,24H,4H2,1-3H3,(H,29,32)(H2,30,31,35)