4-(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)-6-methyl-2-oxidanylidene-N-(phenylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)-6-methyl-2-oxidanylidene-N-(phenylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N-benzyl-4-(4-benzyloxy-3-ethoxy-5-iodo-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)-6-methyl-2-oxo-N-(phenylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N-benzyl-4-(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(4-benzoxy-3-ethoxy-5-iodo-phenyl)-N-benzyl-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C28H28IN3O4 MolecularWeight: 597.44409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)NCC3=CC=CC=C3)I)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)NCC3=CC=CC=C3)I)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28IN3O4/c1-3-35-23-15-21(14-22(29)26(23)36-17-20-12-8-5-9-13-20)25-24(18(2)31-28(34)32-25)27(33)30-16-19-10-6-4-7-11-19/h4-15,25H,3,16-17H2,1-2H3,(H,30,33)(H2,31,32,34)