diethyl 4-(2-dodecyl-6-propan-2-yloxy-phenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(2-dodecyl-6-propan-2-yloxy-phenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate Openeye Name: diethyl 4-(2-dodecyl-6-isopropoxy-phenyl)-6-methyl-2-thioxo-1,4-dihydropyrimidine-3,5-dicarboxylate CAS Name: 4-(2-dodecyl-6-propan-2-yloxyphenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(2-dodecyl-6-propan-2-yloxyphenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate Traditional Name: 4-(2-isopropoxy-6-lauryl-phenyl)-6-methyl-2-thioxo-1,4-dihydropyrimidine-3,5-dicarboxylic acid diethyl ester Formula: C32H50N2O5S MolecularWeight: 574.8148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C(=CC=C1)OC(C)C)C2C(=C(NC(=S)N2C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCC1=C(C(=CC=C1)OC(C)C)C2C(=C(NC(=S)N2C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C32H50N2O5S/c1-7-10-11-12-13-14-15-16-17-18-20-25-21-19-22-26(39-23(4)5)28(25)29-27(30(35)37-8-2)24(6)33-31(40)34(29)32(36)38-9-3/h19,21-23,29H,7-18,20H2,1-6H3,(H,33,40)