4-(3-methoxypiperidin-1-yl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]butane-1-sulfonamide hydrochloride

Systemtic Name: 4-(3-methoxypiperidin-1-yl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]butane-1-sulfonamide hydrochloride Openeye Name: 4-(3-methoxy-1-piperidyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]butane-1-sulfonamide hydrochloride CAS Name: 4-(3-methoxy-1-piperidinyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]-1-butanesulfonamide hydrochloride IUPAC Name: 4-(3-methoxypiperidin-1-yl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]butane-1-sulfonamide hydrochloride Traditional Name: N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]-4-(3-methoxypiperidino)butane-1-sulfonamide hydrochloride Formula: C24H31ClN4O4S MolecularWeight: 507.04534

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCN(C1)CCCCS(=O)(=O)NC2=CC=CC(=C2)C3=NNC(=O)C4=CC=CC=C43.Cl

Isomeric SMILES

COC1CCCN(C1)CCCCS(=O)(=O)NC2=CC=CC(=C2)C3=NNC(=O)C4=CC=CC=C43.Cl

InChI

InChI=1S/C24H30N4O4S.ClH/c1-32-20-10-7-14-28(17-20)13-4-5-15-33(30,31)27-19-9-6-8-18(16-19)23-21-11-2-3-12-22(21)24(29)26-25-23;/h2-3,6,8-9,11-12,16,20,27H,4-5,7,10,13-15,17H2,1H3,(H,26,29);1H