propan-2-yl 3-ethyl-6-[4-[2-(4-fluorophenyl)ethanoylamino]phenyl]-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 3-ethyl-6-[4-[2-(4-fluorophenyl)ethanoylamino]phenyl]-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 3-ethyl-6-[4-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-6-[4-[[2-(4-fluorophenyl)-1-oxoethyl]amino]phenyl]-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-ethyl-6-[4-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-6-[4-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C25H28FN3O3S MolecularWeight: 469.571523

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)NC(=O)CC3=CC=C(C=C3)F)C(=O)OC(C)C)C

Isomeric SMILES

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)NC(=O)CC3=CC=C(C=C3)F)C(=O)OC(C)C)C

InChI

InChI=1S/C25H28FN3O3S/c1-5-29-16(4)22(24(31)32-15(2)3)23(28-25(29)33)18-8-12-20(13-9-18)27-21(30)14-17-6-10-19(26)11-7-17/h6-13,15,23H,5,14H2,1-4H3,(H,27,30)(H,28,33)