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4-(azepan-4-yl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline

4-(azepan-4-yl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline

Systemtic Name:4-(azepan-4-yl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline
Openeye Name:4-(azepan-4-yl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline
CAS Name:4-(4-azepanyl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline
IUPAC Name:4-(azepan-4-yl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline
Traditional Name:4-(azepan-4-yl)-2-methyl-7-[3-(trifluoromethyl)phenyl]quinazoline
Formula: C22H22F3N3
MolecularWeight: 385.42539
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C3=CC(=CC=C3)C(F)(F)F)C(=N1)C4CCCNCC4


Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C3=CC(=CC=C3)C(F)(F)F)C(=N1)C4CCCNCC4


InChI

InChI=1S/C22H22F3N3/c1-14-27-20-13-17(16-4-2-6-18(12-16)22(23,24)25)7-8-19(20)21(28-14)15-5-3-10-26-11-9-15/h2,4,6-8,12-13,15,26H,3,5,9-11H2,1H3


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