ethyl 4-(4-methoxyphenyl)-6-methyl-2-oxidanylidene-1,3-bis[[2-(phenylmethyl)benzimidazol-1-yl]methyl]-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-6-methyl-2-oxidanylidene-1,3-bis[[2-(phenylmethyl)benzimidazol-1-yl]methyl]-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 1,3-bis[(2-benzylbenzimidazol-1-yl)methyl]-4-(4-methoxyphenyl)-6-methyl-2-oxo-4H-pyrimidine-5-carboxylate CAS Name: 4-(4-methoxyphenyl)-6-methyl-2-oxo-1,3-bis[[2-(phenylmethyl)-1-benzimidazolyl]methyl]-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1,3-bis[(2-benzylbenzimidazol-1-yl)methyl]-4-(4-methoxyphenyl)-6-methyl-2-oxo-4H-pyrimidine-5-carboxylate Traditional Name: 1,3-bis[(2-benzylbenzimidazol-1-yl)methyl]-2-keto-4-(4-methoxyphenyl)-6-methyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C45H42N6O4 MolecularWeight: 730.85278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC=C(C=C2)OC)CN3C4=CC=CC=C4N=C3CC5=CC=CC=C5)CN6C7=CC=CC=C7N=C6CC8=CC=CC=C8)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC=C(C=C2)OC)CN3C4=CC=CC=C4N=C3CC5=CC=CC=C5)CN6C7=CC=CC=C7N=C6CC8=CC=CC=C8)C

InChI

InChI=1S/C45H42N6O4/c1-4-55-44(52)42-31(2)48(29-49-38-21-13-11-19-36(38)46-40(49)27-32-15-7-5-8-16-32)45(53)51(43(42)34-23-25-35(54-3)26-24-34)30-50-39-22-14-12-20-37(39)47-41(50)28-33-17-9-6-10-18-33/h5-26,43H,4,27-30H2,1-3H3