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

Systemtic Name: methyl 6-[4-[2-(4-chloranylphenoxy)ethanoylamino]phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-[4-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[4-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C23H24ClN3O4S MolecularWeight: 473.97236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClN3O4S/c1-4-27-14(2)20(22(29)30-3)21(26-23(27)32)15-5-9-17(10-6-15)25-19(28)13-31-18-11-7-16(24)8-12-18/h5-12,21H,4,13H2,1-3H3,(H,25,28)(H,26,32)