ethyl 3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-5,6-diphenyl-pyridazine-4-carboxylate

Systemtic Name: ethyl 3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-5,6-diphenyl-pyridazine-4-carboxylate Openeye Name: ethyl 3-(2-anilino-2-oxo-ethyl)sulfanyl-5,6-diphenyl-pyridazine-4-carboxylate CAS Name: 3-[(2-anilino-2-oxoethyl)thio]-5,6-diphenyl-4-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-anilino-2-oxoethyl)sulfanyl-5,6-diphenylpyridazine-4-carboxylate Traditional Name: 3-[(2-anilino-2-keto-ethyl)thio]-5,6-diphenyl-pyridazine-4-carboxylic acid ethyl ester Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23N3O3S/c1-2-33-27(32)24-23(19-12-6-3-7-13-19)25(20-14-8-4-9-15-20)29-30-26(24)34-18-22(31)28-21-16-10-5-11-17-21/h3-17H,2,18H2,1H3,(H,28,31)