ethyl 4-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OC)COC3=C(C=CC=C3C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OC)COC3=C(C=CC=C3C)C)C

InChI

InChI=1S/C24H28N2O4S/c1-6-29-23(27)20-16(4)25-24(31)26-21(20)17-10-11-19(28-5)18(12-17)13-30-22-14(2)8-7-9-15(22)3/h7-12,21H,6,13H2,1-5H3,(H2,25,26,31)