4-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]quinazoline

Systemtic Name: 4-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]quinazoline Openeye Name: 4-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]quinazoline CAS Name: 4-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]quinazoline IUPAC Name: 4-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]quinazoline Traditional Name: 4-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]quinazoline Formula: C19H18F3N5 MolecularWeight: 373.37493

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=NC3=CC=CC=C32)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C2=NC=NC3=CC=CC=C32)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C19H18F3N5/c20-19(21,22)14-6-7-17(23-12-14)26-8-3-9-27(11-10-26)18-15-4-1-2-5-16(15)24-13-25-18/h1-2,4-7,12-13H,3,8-11H2