N-[(4-chlorophenyl)methyl]-6-nitro-7-piperazin-1-yl-quinazolin-4-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-nitro-7-piperazin-1-yl-quinazolin-4-amine Openeye Name: N-[(4-chlorophenyl)methyl]-6-nitro-7-piperazin-1-yl-quinazolin-4-amine CAS Name: N-[(4-chlorophenyl)methyl]-6-nitro-7-(1-piperazinyl)-4-quinazolinamine IUPAC Name: N-[(4-chlorophenyl)methyl]-6-nitro-7-piperazin-1-ylquinazolin-4-amine Traditional Name: (4-chlorobenzyl)-(6-nitro-7-piperazino-quinazolin-4-yl)amine Formula: C19H19ClN6O2 MolecularWeight: 398.84616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN6O2/c20-14-3-1-13(2-4-14)11-22-19-15-9-18(26(27)28)17(10-16(15)23-12-24-19)25-7-5-21-6-8-25/h1-4,9-10,12,21H,5-8,11H2,(H,22,23,24)