6-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[1-(p-tolylsulfonyl)-4-piperidyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[(1-tosyl-4-piperidyl)carbamoyl]pyridazin-3-olate Formula: C17H19N4O4S- MolecularWeight: 375.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=NN=C(C=C3)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=NN=C(C=C3)[O-]

InChI

InChI=1S/C17H20N4O4S/c1-12-2-4-14(5-3-12)26(24,25)21-10-8-13(9-11-21)18-17(23)15-6-7-16(22)20-19-15/h2-7,13H,8-11H2,1H3,(H,18,23)(H,20,22)/p-1