N-[4-[[4-(6-oxidanylidene-1-phenyl-pyridazin-3-yl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(6-oxidanylidene-1-phenyl-pyridazin-3-yl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(6-oxo-1-phenyl-pyridazin-3-yl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide CAS Name: N-[4-[[4-(6-oxo-1-phenyl-3-pyridazinyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(6-oxo-1-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide Traditional Name: N-[4-[[4-(6-keto-1-phenyl-pyridazin-3-yl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C3=NN(C(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C3=NN(C(=O)C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N5O4S/c1-18(29)24-19-8-10-21(11-9-19)33(31,32)27-15-5-14-26(16-17-27)22-12-13-23(30)28(25-22)20-6-3-2-4-7-20/h2-4,6-13H,5,14-17H2,1H3,(H,24,29)