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

Systemtic Name: 4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 4-keto-4-[4-(2-pyrimidyl)piperazino]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C15H16F3N7O2S MolecularWeight: 415.39345

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F

InChI

InChI=1S/C15H16F3N7O2S/c16-15(17,18)12-22-23-14(28-12)21-10(26)2-3-11(27)24-6-8-25(9-7-24)13-19-4-1-5-20-13/h1,4-5H,2-3,6-9H2,(H,21,23,26)