ethyl (6S)-3-(6-methoxy-6-oxidanylidene-hexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-3-(6-methoxy-6-oxidanylidene-hexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-3-(6-methoxy-6-oxo-hexyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(6-methoxy-6-oxohexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-3-(6-methoxy-6-oxohexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-(6-keto-6-methoxy-hexyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H26N2O4S2 MolecularWeight: 410.55074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=CS2)CCCCCC(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N[C@@H]1C2=CC=CS2)CCCCCC(=O)OC)C

InChI

InChI=1S/C19H26N2O4S2/c1-4-25-18(23)16-13(2)21(11-7-5-6-10-15(22)24-3)19(26)20-17(16)14-9-8-12-27-14/h8-9,12,17H,4-7,10-11H2,1-3H3,(H,20,26)/t17-/m1/s1