6-nitro-N,N-bis(phenylmethyl)-7-piperazin-1-yl-quinazolin-4-amine

Systemtic Name: 6-nitro-N,N-bis(phenylmethyl)-7-piperazin-1-yl-quinazolin-4-amine Openeye Name: N,N-dibenzyl-6-nitro-7-piperazin-1-yl-quinazolin-4-amine CAS Name: 6-nitro-N,N-bis(phenylmethyl)-7-(1-piperazinyl)-4-quinazolinamine IUPAC Name: N,N-dibenzyl-6-nitro-7-piperazin-1-ylquinazolin-4-amine Traditional Name: dibenzyl-(6-nitro-7-piperazino-quinazolin-4-yl)amine Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3N(CC4=CC=CC=C4)CC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3N(CC4=CC=CC=C4)CC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H26N6O2/c33-32(34)25-15-22-23(16-24(25)30-13-11-27-12-14-30)28-19-29-26(22)31(17-20-7-3-1-4-8-20)18-21-9-5-2-6-10-21/h1-10,15-16,19,27H,11-14,17-18H2