N-(3-morpholin-4-ylsulfonylphenyl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-(3-morpholin-4-ylsulfonylphenyl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-(3-morpholinosulfonylphenyl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-[3-(4-morpholinylsulfonyl)phenyl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-(3-morpholin-4-ylsulfonylphenyl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-6-keto-N-(3-morpholinosulfonylphenyl)pyridazine-3-carboxamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O5S/c27-21-10-9-20(24-26(21)16-17-5-2-1-3-6-17)22(28)23-18-7-4-8-19(15-18)32(29,30)25-11-13-31-14-12-25/h1-10,15H,11-14,16H2,(H,23,28)