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

Systemtic Name: ethyl 6-[3-[2-(4-chloranylphenoxy)ethanoylamino]phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H26ClN3O4S MolecularWeight: 487.99894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=S)C2=CC(=CC=C2)NC(=O)COC3=CC=C(C=C3)Cl)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(NC1=S)C2=CC(=CC=C2)NC(=O)COC3=CC=C(C=C3)Cl)C(=O)OCC)C

InChI

InChI=1S/C24H26ClN3O4S/c1-4-28-15(3)21(23(30)31-5-2)22(27-24(28)33)16-7-6-8-18(13-16)26-20(29)14-32-19-11-9-17(25)10-12-19/h6-13,22H,4-5,14H2,1-3H3,(H,26,29)(H,27,33)