N7-ethyl-6-nitro-N4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]quinazoline-4,7-diamine

Systemtic Name: N7-ethyl-6-nitro-N4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]quinazoline-4,7-diamine Openeye Name: N7-ethyl-6-nitro-N4-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]quinazoline-4,7-diamine CAS Name: N7-ethyl-6-nitro-N4-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]quinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-6-nitro-4-N-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]quinazoline-4,7-diamine Traditional Name: ethyl-[6-nitro-4-[[4-(2-pyrrolidinoethoxy)benzyl]amino]quinazolin-7-yl]amine Formula: C23H28N6O3 MolecularWeight: 436.50682

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=C(C=C3)OCCN4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=C(C=C3)OCCN4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N6O3/c1-2-24-21-14-20-19(13-22(21)29(30)31)23(27-16-26-20)25-15-17-5-7-18(8-6-17)32-12-11-28-9-3-4-10-28/h5-8,13-14,16,24H,2-4,9-12,15H2,1H3,(H,25,26,27)