ethyl 6-methyl-1,3-bis[(2-methylbenzimidazol-1-yl)methyl]-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-1,3-bis[(2-methylbenzimidazol-1-yl)methyl]-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-methyl-1,3-bis[(2-methylbenzimidazol-1-yl)methyl]-4-phenyl-2-thioxo-4H-pyrimidine-5-carboxylate CAS Name: 6-methyl-1,3-bis[(2-methyl-1-benzimidazolyl)methyl]-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-1,3-bis[(2-methylbenzimidazol-1-yl)methyl]-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-1,3-bis[(2-methylbenzimidazol-1-yl)methyl]-4-phenyl-2-thioxo-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C32H32N6O2S MolecularWeight: 564.70048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2)CN3C(=NC4=CC=CC=C43)C)CN5C(=NC6=CC=CC=C65)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2)CN3C(=NC4=CC=CC=C43)C)CN5C(=NC6=CC=CC=C65)C)C

InChI

InChI=1S/C32H32N6O2S/c1-5-40-31(39)29-21(2)35(19-36-22(3)33-25-15-9-11-17-27(25)36)32(41)38(30(29)24-13-7-6-8-14-24)20-37-23(4)34-26-16-10-12-18-28(26)37/h6-18,30H,5,19-20H2,1-4H3