4-chloranyl-5-[(1-methylsulfonylpiperidin-4-yl)amino]-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[(1-methylsulfonylpiperidin-4-yl)amino]-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-chloro-5-[(1-methylsulfonyl-4-piperidyl)amino]pyridazin-3-one CAS Name: 4-chloro-5-[(1-methylsulfonyl-4-piperidinyl)amino]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-4-chloro-5-[(1-methylsulfonylpiperidin-4-yl)amino]pyridazin-3-one Traditional Name: 2-benzyl-4-chloro-5-[(1-mesyl-4-piperidyl)amino]pyridazin-3-one Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H21ClN4O3S/c1-26(24,25)21-9-7-14(8-10-21)20-15-11-19-22(17(23)16(15)18)12-13-5-3-2-4-6-13/h2-6,11,14,20H,7-10,12H2,1H3