N2-(3-bromophenyl)-N4-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine

Systemtic Name: N2-(3-bromophenyl)-N4-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine Openeye Name: N2-(3-bromophenyl)-N4-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine CAS Name: N2-(3-bromophenyl)-N4-[2-(1-pyrrolidinyl)ethyl]quinazoline-2,4-diamine IUPAC Name: 2-N-(3-bromophenyl)-4-N-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine Traditional Name: [2-(3-bromoanilino)quinazolin-4-yl]-(2-pyrrolidinoethyl)amine Formula: C20H22BrN5 MolecularWeight: 412.32618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN5/c21-15-6-5-7-16(14-15)23-20-24-18-9-2-1-8-17(18)19(25-20)22-10-13-26-11-3-4-12-26/h1-2,5-9,14H,3-4,10-13H2,(H2,22,23,24,25)