2-(2-piperazin-1-ylethylsulfanyl)-7-(trifluoromethyl)-1,3-benzoxazole

Systemtic Name: 2-(2-piperazin-1-ylethylsulfanyl)-7-(trifluoromethyl)-1,3-benzoxazole Openeye Name: 2-(2-piperazin-1-ylethylsulfanyl)-7-(trifluoromethyl)-1,3-benzoxazole CAS Name: 2-[2-(1-piperazinyl)ethylthio]-7-(trifluoromethyl)-1,3-benzoxazole IUPAC Name: 2-(2-piperazin-1-ylethylsulfanyl)-7-(trifluoromethyl)-1,3-benzoxazole Traditional Name: 2-(2-piperazinoethylthio)-7-(trifluoromethyl)-1,3-benzoxazole Formula: C14H16F3N3OS MolecularWeight: 331.35655

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCSC2=NC3=CC=CC(=C3O2)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)CCSC2=NC3=CC=CC(=C3O2)C(F)(F)F

InChI

InChI=1S/C14H16F3N3OS/c15-14(16,17)10-2-1-3-11-12(10)21-13(19-11)22-9-8-20-6-4-18-5-7-20/h1-3,18H,4-9H2