N-[4-(azocan-1-ylsulfonyl)phenyl]-1-(3-chlorophenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[4-(azocan-1-ylsulfonyl)phenyl]-1-(3-chlorophenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[4-(azocan-1-ylsulfonyl)phenyl]-1-(3-chlorophenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-[4-(1-azocanylsulfonyl)phenyl]-1-(3-chlorophenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-[4-(azocan-1-ylsulfonyl)phenyl]-1-(3-chlorophenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-[4-(azocan-1-ylsulfonyl)phenyl]-1-(3-chlorophenyl)-4-keto-pyridazine-3-carboxamide Formula: C24H25ClN4O4S MolecularWeight: 500.9977

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=CC3=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=CC3=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H25ClN4O4S/c25-18-7-6-8-20(17-18)29-16-13-22(30)23(27-29)24(31)26-19-9-11-21(12-10-19)34(32,33)28-14-4-2-1-3-5-15-28/h6-13,16-17H,1-5,14-15H2,(H,26,31)