1-(cyclohexylmethyl)-5-(4-methylsulfonylphenyl)-3-[(E)-prop-1-enyl]pyrazole

Systemtic Name: 1-(cyclohexylmethyl)-5-(4-methylsulfonylphenyl)-3-[(E)-prop-1-enyl]pyrazole Openeye Name: 1-(cyclohexylmethyl)-5-(4-methylsulfonylphenyl)-3-[(E)-prop-1-enyl]pyrazole CAS Name: 1-(cyclohexylmethyl)-5-(4-methylsulfonylphenyl)-3-[(E)-prop-1-enyl]pyrazole IUPAC Name: 1-(cyclohexylmethyl)-5-(4-methylsulfonylphenyl)-3-[(E)-prop-1-enyl]pyrazole Traditional Name: 1-(cyclohexylmethyl)-5-(4-mesylphenyl)-3-[(E)-prop-1-enyl]pyrazole Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=NN(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)CC3CCCCC3

Isomeric SMILES

C/C=C/C1=NN(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)CC3CCCCC3

InChI

InChI=1S/C20H26N2O2S/c1-3-7-18-14-20(17-10-12-19(13-11-17)25(2,23)24)22(21-18)15-16-8-5-4-6-9-16/h3,7,10-14,16H,4-6,8-9,15H2,1-2H3/b7-3+