ethyl (6S)-6-(4-dimethylaminophenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-6-(4-dimethylaminophenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-6-(4-dimethylaminophenyl)-4-methyl-3-phenethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(4-dimethylaminophenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-6-(4-dimethylaminophenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(4-dimethylaminophenyl)-4-methyl-3-phenethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)N(C)C)CCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N[C@H]1C2=CC=C(C=C2)N(C)C)CCC3=CC=CC=C3)C

InChI

InChI=1S/C24H29N3O2S/c1-5-29-23(28)21-17(2)27(16-15-18-9-7-6-8-10-18)24(30)25-22(21)19-11-13-20(14-12-19)26(3)4/h6-14,22H,5,15-16H2,1-4H3,(H,25,30)/t22-/m0/s1