(phenylmethyl) 3,4-dimethyl-2-sulfanylidene-6-(3-thiophen-2-ylcarbonyloxyphenyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 3,4-dimethyl-2-sulfanylidene-6-(3-thiophen-2-ylcarbonyloxyphenyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: benzyl 3,4-dimethyl-6-[3-(thiophene-2-carbonyloxy)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-6-[3-[oxo(thiophen-2-yl)methoxy]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3,4-dimethyl-2-sulfanylidene-6-[3-(thiophene-2-carbonyloxy)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3,4-dimethyl-6-[3-(2-thenoyloxy)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid benzyl ester Formula: C25H22N2O4S2 MolecularWeight: 478.58318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)OC(=O)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)OC(=O)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4S2/c1-16-21(24(29)30-15-17-8-4-3-5-9-17)22(26-25(32)27(16)2)18-10-6-11-19(14-18)31-23(28)20-12-7-13-33-20/h3-14,22H,15H2,1-2H3,(H,26,32)