ethyl (6R)-4-methyl-6-(3-nitrophenyl)-3-[[(2R)-oxolan-2-yl]methyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6R)-4-methyl-6-(3-nitrophenyl)-3-[[(2R)-oxolan-2-yl]methyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6R)-4-methyl-6-(3-nitrophenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-4-methyl-6-(3-nitrophenyl)-3-[[(2R)-2-oxolanyl]methyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-4-methyl-6-(3-nitrophenyl)-3-[[(2R)-oxolan-2-yl]methyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-4-methyl-6-(3-nitrophenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC(=CC=C2)[N+](=O)[O-])CC3CCCO3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N[C@@H]1C2=CC(=CC=C2)[N+](=O)[O-])C[C@H]3CCCO3)C

InChI

InChI=1S/C19H23N3O5S/c1-3-26-18(23)16-12(2)21(11-15-8-5-9-27-15)19(28)20-17(16)13-6-4-7-14(10-13)22(24)25/h4,6-7,10,15,17H,3,5,8-9,11H2,1-2H3,(H,20,28)/t15-,17-/m1/s1