2-(phenylmethyl)-6-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]carbonyl-pyridazin-3-one

Systemtic Name: 2-(phenylmethyl)-6-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]carbonyl-pyridazin-3-one Openeye Name: 2-benzyl-6-(4-tetralin-6-ylsulfonylpiperazine-1-carbonyl)pyridazin-3-one CAS Name: 6-[oxo-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbonyl]pyridazin-3-one Traditional Name: 2-benzyl-6-(4-tetralin-6-ylsulfonylpiperazine-1-carbonyl)pyridazin-3-one Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H28N4O4S/c31-25-13-12-24(27-30(25)19-20-6-2-1-3-7-20)26(32)28-14-16-29(17-15-28)35(33,34)23-11-10-21-8-4-5-9-22(21)18-23/h1-3,6-7,10-13,18H,4-5,8-9,14-17,19H2