2-methoxyethyl (6S)-3-(3,5-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6S)-3-(3,5-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-3-(3,5-dimethylphenyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(3,5-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-3-(3,5-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-(3,5-dimethylphenyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(C(NC2=S)C3=CC=CS3)C(=O)OCCOC)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C([C@H](NC2=S)C3=CC=CS3)C(=O)OCCOC)C)C

InChI

InChI=1S/C21H24N2O3S2/c1-13-10-14(2)12-16(11-13)23-15(3)18(20(24)26-8-7-25-4)19(22-21(23)27)17-6-5-9-28-17/h5-6,9-12,19H,7-8H2,1-4H3,(H,22,27)/t19-/m1/s1