2-methoxyethyl 3-cyclopropyl-6-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 3-cyclopropyl-6-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 3-cyclopropyl-6-(4-ethoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-cyclopropyl-6-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-cyclopropyl-6-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-cyclopropyl-4-methyl-6-p-phenetyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(=C(N(C(=S)N2)C3CC3)C)C(=O)OCCOC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(=C(N(C(=S)N2)C3CC3)C)C(=O)OCCOC

InChI

InChI=1S/C20H26N2O4S/c1-4-25-16-9-5-14(6-10-16)18-17(19(23)26-12-11-24-3)13(2)22(15-7-8-15)20(27)21-18/h5-6,9-10,15,18H,4,7-8,11-12H2,1-3H3,(H,21,27)