N-[2-(1H-indol-3-yl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4-amine

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4-amine Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4-amine CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(4-nitrophenyl)-1-piperazinyl]-4-quinazolinamine IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]quinazolin-4-amine Traditional Name: 2-(1H-indol-3-yl)ethyl-[2-[4-(4-nitrophenyl)piperazino]quinazolin-4-yl]amine Formula: C28H27N7O2 MolecularWeight: 493.55968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=N3)NCCC5=CNC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=N3)NCCC5=CNC6=CC=CC=C65

InChI

InChI=1S/C28H27N7O2/c36-35(37)22-11-9-21(10-12-22)33-15-17-34(18-16-33)28-31-26-8-4-2-6-24(26)27(32-28)29-14-13-20-19-30-25-7-3-1-5-23(20)25/h1-12,19,30H,13-18H2,(H,29,31,32)