ethyl 3-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5,6-diphenyl-pyridazine-4-carboxylate

Systemtic Name: ethyl 3-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5,6-diphenyl-pyridazine-4-carboxylate Openeye Name: ethyl 3-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-5,6-diphenyl-pyridazine-4-carboxylate CAS Name: 3-[[2-(4-methylanilino)-2-oxoethyl]thio]-5,6-diphenyl-4-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-5,6-diphenylpyridazine-4-carboxylate Traditional Name: 3-[[2-keto-2-(p-toluidino)ethyl]thio]-5,6-diphenyl-pyridazine-4-carboxylic acid ethyl ester Formula: C28H25N3O3S MolecularWeight: 483.5814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H25N3O3S/c1-3-34-28(33)25-24(20-10-6-4-7-11-20)26(21-12-8-5-9-13-21)30-31-27(25)35-18-23(32)29-22-16-14-19(2)15-17-22/h4-17H,3,18H2,1-2H3,(H,29,32)