3-(4-tert-butylphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-(4-tert-butylphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile Openeye Name: 3-(4-tert-butylphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile CAS Name: 3-(4-tert-butylphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile IUPAC Name: 3-(4-tert-butylphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile Traditional Name: 3-(4-tert-butylphenyl)-5-mesyl-1H-pyrazole-4-carbonitrile Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=C2C#N)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=C2C#N)S(=O)(=O)C

InChI

InChI=1S/C15H17N3O2S/c1-15(2,3)11-7-5-10(6-8-11)13-12(9-16)14(18-17-13)21(4,19)20/h5-8H,1-4H3,(H,17,18)