N-(2-chloranyl-5-methylsulfonyl-phenyl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C20H18ClN3O5S MolecularWeight: 447.89202

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

InChI

InChI=1S/C20H18ClN3O5S/c1-30(27,28)15-7-8-16(21)18(13-15)22-20(26)17-9-10-19(25)24(23-17)11-12-29-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,22,26)