ethyl 4-methyl-3-phenyl-6-[4-(pyridin-3-ylmethoxy)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-3-phenyl-6-[4-(pyridin-3-ylmethoxy)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-3-phenyl-6-[4-(3-pyridylmethoxy)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-3-phenyl-6-[4-(3-pyridinylmethoxy)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-phenyl-6-[4-(pyridin-3-ylmethoxy)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-methyl-3-phenyl-6-[4-(3-pyridylmethoxy)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)OCC3=CN=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)OCC3=CN=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H25N3O3S/c1-3-31-25(30)23-18(2)29(21-9-5-4-6-10-21)26(33)28-24(23)20-11-13-22(14-12-20)32-17-19-8-7-15-27-16-19/h4-16,24H,3,17H2,1-2H3,(H,28,33)