[4,4-dimethyl-2-(4-methylsulfonylphenyl)-3H-pyrazol-5-yl] N,N-dimethylcarbamate

Systemtic Name: [4,4-dimethyl-2-(4-methylsulfonylphenyl)-3H-pyrazol-5-yl] N,N-dimethylcarbamate Openeye Name: [4,4-dimethyl-2-(4-methylsulfonylphenyl)-3H-pyrazol-5-yl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [4,4-dimethyl-2-(4-methylsulfonylphenyl)-3H-pyrazol-5-yl] ester IUPAC Name: [4,4-dimethyl-2-(4-methylsulfonylphenyl)-3H-pyrazol-5-yl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [1-(4-mesylphenyl)-4,4-dimethyl-2-pyrazolin-3-yl] ester Formula: C15H21N3O4S MolecularWeight: 339.40994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(N=C1OC(=O)N(C)C)C2=CC=C(C=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1(CN(N=C1OC(=O)N(C)C)C2=CC=C(C=C2)S(=O)(=O)C)C

InChI

InChI=1S/C15H21N3O4S/c1-15(2)10-18(16-13(15)22-14(19)17(3)4)11-6-8-12(9-7-11)23(5,20)21/h6-9H,10H2,1-5H3