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

Systemtic Name: 2-methoxyethyl (6R)-6-[4-(cyanomethoxy)phenyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-6-[4-(cyanomethoxy)phenyl]-3-cyclopropyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-(cyanomethoxy)phenyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-6-[4-(cyanomethoxy)phenyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-[4-(cyanomethoxy)phenyl]-3-cyclopropyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2CC2)C3=CC=C(C=C3)OCC#N)C(=O)OCCOC

InChI

InChI=1S/C20H23N3O4S/c1-13-17(19(24)27-12-11-25-2)18(22-20(28)23(13)15-5-6-15)14-3-7-16(8-4-14)26-10-9-21/h3-4,7-8,15,18H,5-6,10-12H2,1-2H3,(H,22,28)/t18-/m1/s1