N-cyclopropyl-4-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbothioamide Openeye Name: N-cyclopropyl-4-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbothioamide CAS Name: N-cyclopropyl-4-[4-(1-methyl-4-pyrazolyl)-6-(trifluoromethyl)-2-pyrimidinyl]-1-piperazinecarbothioamide IUPAC Name: N-cyclopropyl-4-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbothioamide Traditional Name: N-cyclopropyl-4-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbothioamide Formula: C17H20F3N7S MolecularWeight: 411.44781

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC(=NC(=N2)N3CCN(CC3)C(=S)NC4CC4)C(F)(F)F

Isomeric SMILES

CN1C=C(C=N1)C2=CC(=NC(=N2)N3CCN(CC3)C(=S)NC4CC4)C(F)(F)F

InChI

InChI=1S/C17H20F3N7S/c1-25-10-11(9-21-25)13-8-14(17(18,19)20)24-15(23-13)26-4-6-27(7-5-26)16(28)22-12-2-3-12/h8-10,12H,2-7H2,1H3,(H,22,28)