2-cyclopropyl-5-[4-[4-(trifluoromethylsulfanyl)phenyl]carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-cyclopropyl-5-[4-[4-(trifluoromethylsulfanyl)phenyl]carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-cyclopropyl-5-[4-[4-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-cyclopropyl-5-[4-[oxo-[4-(trifluoromethylthio)phenyl]methyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-cyclopropyl-5-[4-[4-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-cyclopropyl-5-[4-[4-(trifluoromethylthio)benzoyl]piperazino]oxazole-4-carbonitrile Formula: C19H17F3N4O2S MolecularWeight: 422.42409

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)SC(F)(F)F)C#N

Isomeric SMILES

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)SC(F)(F)F)C#N

InChI

InChI=1S/C19H17F3N4O2S/c20-19(21,22)29-14-5-3-13(4-6-14)17(27)25-7-9-26(10-8-25)18-15(11-23)24-16(28-18)12-1-2-12/h3-6,12H,1-2,7-10H2