2-methoxyethyl (6S)-6-[4-(cyanomethoxy)phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6S)-6-[4-(cyanomethoxy)phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-6-[4-(cyanomethoxy)phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-[4-(cyanomethoxy)phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-6-[4-(cyanomethoxy)phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-[4-(cyanomethoxy)phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)OCC#N)C(=O)OCCOC)C

Isomeric SMILES

CCN1C(=C([C@@H](NC1=S)C2=CC=C(C=C2)OCC#N)C(=O)OCCOC)C

InChI

InChI=1S/C19H23N3O4S/c1-4-22-13(2)16(18(23)26-12-11-24-3)17(21-19(22)27)14-5-7-15(8-6-14)25-10-9-20/h5-8,17H,4,10-12H2,1-3H3,(H,21,27)/t17-/m0/s1