4-(1-methylpyrazol-4-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-yl]pyrimidine

Systemtic Name: 4-(1-methylpyrazol-4-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-yl]pyrimidine Openeye Name: 4-(1-methylpyrazol-4-yl)-2-[(3S)-3-(trifluoromethyl)-1-piperidyl]pyrimidine CAS Name: 4-(1-methyl-4-pyrazolyl)-2-[(3S)-3-(trifluoromethyl)-1-piperidinyl]pyrimidine IUPAC Name: 4-(1-methylpyrazol-4-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-yl]pyrimidine Traditional Name: 4-(1-methylpyrazol-4-yl)-2-[(3S)-3-(trifluoromethyl)piperidino]pyrimidine Formula: C14H16F3N5 MolecularWeight: 311.30555

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=NC=C2)N3CCCC(C3)C(F)(F)F

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=NC=C2)N3CCC[C@@H](C3)C(F)(F)F

InChI

InChI=1S/C14H16F3N5/c1-21-8-10(7-19-21)12-4-5-18-13(20-12)22-6-2-3-11(9-22)14(15,16)17/h4-5,7-8,11H,2-3,6,9H2,1H3/t11-/m0/s1