4-[(5-methyl-1H-pyrazol-3-yl)amino]-5-methylsulfonyl-2-(phenylmethyl)phthalazin-1-one

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-5-methylsulfonyl-2-(phenylmethyl)phthalazin-1-one Openeye Name: 2-benzyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-5-methylsulfonyl-phthalazin-1-one CAS Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-5-methylsulfonyl-2-(phenylmethyl)-1-phthalazinone IUPAC Name: 2-benzyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-5-methylsulfonylphthalazin-1-one Traditional Name: 2-benzyl-5-mesyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]phthalazin-1-one Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C(=CC=C3)S(=O)(=O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C(=CC=C3)S(=O)(=O)C)CC4=CC=CC=C4

InChI

InChI=1S/C20H19N5O3S/c1-13-11-17(23-22-13)21-19-18-15(9-6-10-16(18)29(2,27)28)20(26)25(24-19)12-14-7-4-3-5-8-14/h3-11H,12H2,1-2H3,(H2,21,22,23,24)