2-(cyclopropylmethyl)-5-(3-methylsulfonylphenyl)-4-phenyl-pyridazin-3-one

Systemtic Name: 2-(cyclopropylmethyl)-5-(3-methylsulfonylphenyl)-4-phenyl-pyridazin-3-one Openeye Name: 2-(cyclopropylmethyl)-5-(3-methylsulfonylphenyl)-4-phenyl-pyridazin-3-one CAS Name: 2-(cyclopropylmethyl)-5-(3-methylsulfonylphenyl)-4-phenyl-3-pyridazinone IUPAC Name: 2-(cyclopropylmethyl)-5-(3-methylsulfonylphenyl)-4-phenylpyridazin-3-one Traditional Name: 2-(cyclopropylmethyl)-5-(3-mesylphenyl)-4-phenyl-pyridazin-3-one Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C(=O)N(N=C2)CC3CC3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C(=O)N(N=C2)CC3CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O3S/c1-27(25,26)18-9-5-8-17(12-18)19-13-22-23(14-15-10-11-15)21(24)20(19)16-6-3-2-4-7-16/h2-9,12-13,15H,10-11,14H2,1H3