2-(4-chlorophenyl)-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(4-chlorophenyl)-6-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(4-chlorophenyl)-6-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(4-chlorophenyl)-6-[[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(4-chlorophenyl)-6-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(4-chlorophenyl)-6-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C21H20ClN5O6S MolecularWeight: 505.9314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN5O6S/c22-15-4-6-16(7-5-15)26-20(28)9-8-19(23-26)21(29)24-10-12-25(13-11-24)34(32,33)18-3-1-2-17(14-18)27(30)31/h1-7,14H,8-13H2