methyl 4-[(6R)-5-(dimethylcarbamoyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate

Systemtic Name: methyl 4-[(6R)-5-(dimethylcarbamoyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 4-[(6R)-5-(dimethylcarbamoyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 4-[(6R)-5-[dimethylamino(oxo)methyl]-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6R)-5-(dimethylcarbamoyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 4-[(6R)-5-(dimethylcarbamoyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC=C(C=C2)C(=O)OC)C(=O)N(C)C)C

Isomeric SMILES

CCCN1C(=C([C@H](NC1=S)C2=CC=C(C=C2)C(=O)OC)C(=O)N(C)C)C

InChI

InChI=1S/C19H25N3O3S/c1-6-11-22-12(2)15(17(23)21(3)4)16(20-19(22)26)13-7-9-14(10-8-13)18(24)25-5/h7-10,16H,6,11H2,1-5H3,(H,20,26)/t16-/m1/s1