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

Systemtic Name: 2-methoxyethyl (6R)-6-[4-(cyanomethoxy)phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-6-[4-(cyanomethoxy)phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-(cyanomethoxy)phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-6-[4-(cyanomethoxy)phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-[4-(cyanomethoxy)phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC=C(C=C2)OCC#N)C(=O)OCCOC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C)C2=CC=C(C=C2)OCC#N)C(=O)OCCOC

InChI

InChI=1S/C18H21N3O4S/c1-12-15(17(22)25-11-10-23-3)16(20-18(26)21(12)2)13-4-6-14(7-5-13)24-9-8-19/h4-7,16H,9-11H2,1-3H3,(H,20,26)/t16-/m1/s1