methyl 4-[[4-(6-methyl-5-morpholin-4-ylcarbonyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)phenoxy]methyl]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)C(=O)N4CCOCC4

InChI

InChI=1S/C25H27N3O5S/c1-16-21(23(29)28-11-13-32-14-12-28)22(27-25(34)26-16)18-7-9-20(10-8-18)33-15-17-3-5-19(6-4-17)24(30)31-2/h3-10,22H,11-15H2,1-2H3,(H2,26,27,34)