methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate

Systemtic Name: methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-[4-morpholinyl(oxo)methyl]-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)OC)C3=CC=CC=C3C(=O)OC)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)OC)C3=CC=CC=C3C(=O)OC)C(=O)N4CCOCC4

InChI

InChI=1S/C25H27N3O5S/c1-16-21(23(29)27-12-14-33-15-13-27)22(19-6-4-5-7-20(19)24(30)32-3)26-25(34)28(16)17-8-10-18(31-2)11-9-17/h4-11,22H,12-15H2,1-3H3,(H,26,34)