3-(4-methoxyphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-(4-methoxyphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile Openeye Name: 3-(4-methoxyphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile CAS Name: 3-(4-methoxyphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile IUPAC Name: 3-(4-methoxyphenyl)-5-methylsulfonyl-1H-pyrazole-4-carbonitrile Traditional Name: 5-mesyl-3-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C2C#N)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C2C#N)S(=O)(=O)C

InChI

InChI=1S/C12H11N3O3S/c1-18-9-5-3-8(4-6-9)11-10(7-13)12(15-14-11)19(2,16)17/h3-6H,1-2H3,(H,14,15)