3-(4-methylphenyl)-2-(4-methylsulfonylphenyl)-3,4-dihydropyrazole-5-carbonitrile

Systemtic Name: 3-(4-methylphenyl)-2-(4-methylsulfonylphenyl)-3,4-dihydropyrazole-5-carbonitrile Openeye Name: 2-(4-methylsulfonylphenyl)-3-(p-tolyl)-3,4-dihydropyrazole-5-carbonitrile CAS Name: 3-(4-methylphenyl)-2-(4-methylsulfonylphenyl)-3,4-dihydropyrazole-5-carbonitrile IUPAC Name: 3-(4-methylphenyl)-2-(4-methylsulfonylphenyl)-3,4-dihydropyrazole-5-carbonitrile Traditional Name: 1-(4-mesylphenyl)-5-(p-tolyl)-2-pyrazoline-3-carbonitrile Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)S(=O)(=O)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)S(=O)(=O)C)C#N

InChI

InChI=1S/C18H17N3O2S/c1-13-3-5-14(6-4-13)18-11-15(12-19)20-21(18)16-7-9-17(10-8-16)24(2,22)23/h3-10,18H,11H2,1-2H3