N2-[3,5-bis(trifluoromethyl)phenyl]-N4-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine

Systemtic Name: N2-[3,5-bis(trifluoromethyl)phenyl]-N4-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine Openeye Name: N2-[3,5-bis(trifluoromethyl)phenyl]-N4-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine CAS Name: N2-[3,5-bis(trifluoromethyl)phenyl]-N4-[2-(1-pyrrolidinyl)ethyl]quinazoline-2,4-diamine IUPAC Name: 2-N-[3,5-bis(trifluoromethyl)phenyl]-4-N-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine Traditional Name: [2-[3,5-bis(trifluoromethyl)anilino]quinazolin-4-yl]-(2-pyrrolidinoethyl)amine Formula: C22H21F6N5 MolecularWeight: 469.426059

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC2=NC(=NC3=CC=CC=C32)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CCN(C1)CCNC2=NC(=NC3=CC=CC=C32)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H21F6N5/c23-21(24,25)14-11-15(22(26,27)28)13-16(12-14)30-20-31-18-6-2-1-5-17(18)19(32-20)29-7-10-33-8-3-4-9-33/h1-2,5-6,11-13H,3-4,7-10H2,(H2,29,30,31,32)