4-methyl-6-[4-[3-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]pyrimidin-2-amine

Systemtic Name: 4-methyl-6-[4-[3-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]pyrimidin-2-amine Openeye Name: 4-methyl-6-[4-[3-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]pyrimidin-2-amine CAS Name: 4-methyl-6-[4-[3-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]-2-pyrimidinamine IUPAC Name: 4-methyl-6-[4-[3-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]pyrimidin-2-amine Traditional Name: [4-methyl-6-[4-[3-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]pyrimidin-2-yl]amine Formula: C16H19F3N6 MolecularWeight: 352.35747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)N2CCCN(CC2)C3=C(C=CC=N3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)N)N2CCCN(CC2)C3=C(C=CC=N3)C(F)(F)F

InChI

InChI=1S/C16H19F3N6/c1-11-10-13(23-15(20)22-11)24-6-3-7-25(9-8-24)14-12(16(17,18)19)4-2-5-21-14/h2,4-5,10H,3,6-9H2,1H3,(H2,20,22,23)