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

Systemtic Name: 2-methoxyethyl 3-cyclopropyl-4-methyl-6-(4-propan-2-ylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 3-cyclopropyl-6-(4-isopropylphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-cyclopropyl-4-methyl-6-(4-propan-2-ylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-cyclopropyl-4-methyl-6-(4-propan-2-ylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-cyclopropyl-4-methyl-6-p-cumenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2CC2)C3=CC=C(C=C3)C(C)C)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(NC(=S)N1C2CC2)C3=CC=C(C=C3)C(C)C)C(=O)OCCOC

InChI

InChI=1S/C21H28N2O3S/c1-13(2)15-5-7-16(8-6-15)19-18(20(24)26-12-11-25-4)14(3)23(17-9-10-17)21(27)22-19/h5-8,13,17,19H,9-12H2,1-4H3,(H,22,27)