6-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 6-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-6-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)pyridazin-3-one CAS Name: 6-[[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-oxomethyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazine-1-carbonyl]pyridazin-3-one Traditional Name: 2-benzyl-6-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)pyridazin-3-one Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O4S/c30-24-12-11-23(26-29(24)18-19-5-2-1-3-6-19)25(31)27-13-15-28(16-14-27)34(32,33)22-10-9-20-7-4-8-21(20)17-22/h1-3,5-6,9-12,17H,4,7-8,13-16,18H2