1-(4-methylsulfonylphenyl)-5-[4-(3-pyrrolidin-1-ylprop-1-ynyl)phenyl]-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-(4-methylsulfonylphenyl)-5-[4-(3-pyrrolidin-1-ylprop-1-ynyl)phenyl]-3-(trifluoromethyl)pyrazole Openeye Name: 1-(4-methylsulfonylphenyl)-5-[4-(3-pyrrolidin-1-ylprop-1-ynyl)phenyl]-3-(trifluoromethyl)pyrazole CAS Name: 1-(4-methylsulfonylphenyl)-5-[4-[3-(1-pyrrolidinyl)prop-1-ynyl]phenyl]-3-(trifluoromethyl)pyrazole IUPAC Name: 1-(4-methylsulfonylphenyl)-5-[4-(3-pyrrolidin-1-ylprop-1-ynyl)phenyl]-3-(trifluoromethyl)pyrazole Traditional Name: 1-(4-mesylphenyl)-5-[4-(3-pyrrolidinoprop-1-ynyl)phenyl]-3-(trifluoromethyl)pyrazole Formula: C24H22F3N3O2S MolecularWeight: 473.51059

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)C#CCN4CCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)C#CCN4CCCC4

InChI

InChI=1S/C24H22F3N3O2S/c1-33(31,32)21-12-10-20(11-13-21)30-22(17-23(28-30)24(25,26)27)19-8-6-18(7-9-19)5-4-16-29-14-2-3-15-29/h6-13,17H,2-3,14-16H2,1H3