(4S)-2-(2-chlorophenyl)sulfonyl-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one

Systemtic Name: (4S)-2-(2-chlorophenyl)sulfonyl-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one Openeye Name: (4S)-2-(2-chlorophenyl)sulfonyl-5-methyl-4-(2-methylallyl)-4H-pyrazol-3-one CAS Name: (4S)-2-(2-chlorophenyl)sulfonyl-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one IUPAC Name: (4S)-2-(2-chlorophenyl)sulfonyl-5-methyl-4-(2-methylprop-2-enyl)-4H-pyrazol-3-one Traditional Name: (4S)-2-(2-chlorophenyl)sulfonyl-5-methyl-4-(2-methylallyl)-2-pyrazolin-3-one Formula: C14H15ClN2O3S MolecularWeight: 326.7985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CC(=C)C)S(=O)(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=NN(C(=O)[C@H]1CC(=C)C)S(=O)(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C14H15ClN2O3S/c1-9(2)8-11-10(3)16-17(14(11)18)21(19,20)13-7-5-4-6-12(13)15/h4-7,11H,1,8H2,2-3H3/t11-/m0/s1