N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-6-chloranyl-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-6-chloranyl-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]-6-chloro-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]-6-chloro-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-6-chloro-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6-chloro-2-(trifluoromethyl)quinazolin-4-yl]-(1-piperonyl-4-piperidyl)amine Formula: C22H20ClF3N4O2 MolecularWeight: 464.86801

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC(=NC3=C2C=C(C=C3)Cl)C(F)(F)F)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1NC2=NC(=NC3=C2C=C(C=C3)Cl)C(F)(F)F)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H20ClF3N4O2/c23-14-2-3-17-16(10-14)20(29-21(28-17)22(24,25)26)27-15-5-7-30(8-6-15)11-13-1-4-18-19(9-13)32-12-31-18/h1-4,9-10,15H,5-8,11-12H2,(H,27,28,29)