methyl 3-[3-(dimethylamino)propyl]-6-(4-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-[3-(dimethylamino)propyl]-6-(4-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-[3-(dimethylamino)propyl]-6-(4-fluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-[3-(dimethylamino)propyl]-6-(4-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-(dimethylamino)propyl]-6-(4-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-[3-(dimethylamino)propyl]-6-(4-fluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H24FN3O2S MolecularWeight: 365.465463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1CCCN(C)C)C2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1CCCN(C)C)C2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C18H24FN3O2S/c1-12-15(17(23)24-4)16(13-6-8-14(19)9-7-13)20-18(25)22(12)11-5-10-21(2)3/h6-9,16H,5,10-11H2,1-4H3,(H,20,25)