4-oxidanylidene-4-(4-phenylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 4-oxidanylidene-4-(4-phenylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 4-oxo-4-(4-phenylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 4-oxo-4-(4-phenyl-1-piperazinyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-oxo-4-(4-phenylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 4-keto-4-(4-phenylpiperazino)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C17H18F3N5O2S MolecularWeight: 413.41733

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F

InChI

InChI=1S/C17H18F3N5O2S/c18-17(19,20)15-22-23-16(28-15)21-13(26)6-7-14(27)25-10-8-24(9-11-25)12-4-2-1-3-5-12/h1-5H,6-11H2,(H,21,23,26)