[4-(2-iodanyl-4-methoxy-3-oxidanyl-phenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone

Systemtic Name: [4-(2-iodanyl-4-methoxy-3-oxidanyl-phenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone Openeye Name: [4-(3-hydroxy-2-iodo-4-methoxy-phenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone CAS Name: [4-(3-hydroxy-2-iodo-4-methoxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenylmethanone IUPAC Name: [4-(3-hydroxy-2-iodo-4-methoxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-phenylmethanone Traditional Name: [4-(3-hydroxy-2-iodo-4-methoxy-phenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-phenyl-methanone Formula: C24H19IN2O3S MolecularWeight: 542.38873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)I)O

Isomeric SMILES

COC1=C(C(=C(C=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)I)O

InChI

InChI=1S/C24H19IN2O3S/c1-30-17-13-12-16(19(25)23(17)29)21-18(22(28)15-10-6-3-7-11-15)20(26-24(31)27-21)14-8-4-2-5-9-14/h2-13,21,29H,1H3,(H2,26,27,31)