N-(3-chlorophenyl)-4-(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N-(3-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-iodo-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: N-(3-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-iodophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N-(3-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-iodophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: N-(3-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-iodo-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C20H19ClIN3O3S MolecularWeight: 543.80563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClIN3O3S/c1-3-28-15-8-11(7-14(22)18(15)26)17-16(10(2)23-20(29)25-17)19(27)24-13-6-4-5-12(21)9-13/h4-9,17,26H,3H2,1-2H3,(H,24,27)(H2,23,25,29)