N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-(4-chloro-3-morpholinosulfonyl-phenyl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-N-(4-chloro-3-morpholinosulfonyl-phenyl)-6-keto-pyridazine-3-carboxamide Formula: C22H21ClN4O5S MolecularWeight: 488.94394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H21ClN4O5S/c23-18-7-6-17(14-20(18)33(30,31)26-10-12-32-13-11-26)24-22(29)19-8-9-21(28)27(25-19)15-16-4-2-1-3-5-16/h1-9,14H,10-13,15H2,(H,24,29)