diethyl 4-[2-[(4-methylphenyl)carbamoylamino]phenyl]sulfanylpyridine-2,6-dicarboxylate

Systemtic Name: diethyl 4-[2-[(4-methylphenyl)carbamoylamino]phenyl]sulfanylpyridine-2,6-dicarboxylate Openeye Name: diethyl 4-[2-(p-tolylcarbamoylamino)phenyl]sulfanylpyridine-2,6-dicarboxylate CAS Name: 4-[[2-[[(4-methylanilino)-oxomethyl]amino]phenyl]thio]pyridine-2,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[2-[(4-methylphenyl)carbamoylamino]phenyl]sulfanylpyridine-2,6-dicarboxylate Traditional Name: 4-[[2-(p-tolylcarbamoylamino)phenyl]thio]pyridine-2,6-dicarboxylic acid diethyl ester Formula: C25H25N3O5S MolecularWeight: 479.5481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=N1)C(=O)OCC)SC2=CC=CC=C2NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=N1)C(=O)OCC)SC2=CC=CC=C2NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C25H25N3O5S/c1-4-32-23(29)20-14-18(15-21(27-20)24(30)33-5-2)34-22-9-7-6-8-19(22)28-25(31)26-17-12-10-16(3)11-13-17/h6-15H,4-5H2,1-3H3,(H2,26,28,31)