1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole Openeye Name: 1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-5-(2-thienyl)-3-(trifluoromethyl)pyrazole CAS Name: 1-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole IUPAC Name: 1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole Traditional Name: 1-[4-(3-pyrrolidinopropoxy)phenyl]-5-(2-thienyl)-3-(trifluoromethyl)pyrazole Formula: C21H22F3N3OS MolecularWeight: 421.47909

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)CCCOC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C21H22F3N3OS/c22-21(23,24)20-15-18(19-5-3-14-29-19)27(25-20)16-6-8-17(9-7-16)28-13-4-12-26-10-1-2-11-26/h3,5-9,14-15H,1-2,4,10-13H2