6-nitro-N-(phenylmethyl)-7-piperazin-1-yl-quinazolin-2-amine

Systemtic Name: 6-nitro-N-(phenylmethyl)-7-piperazin-1-yl-quinazolin-2-amine Openeye Name: N-benzyl-6-nitro-7-piperazin-1-yl-quinazolin-2-amine CAS Name: 6-nitro-N-(phenylmethyl)-7-(1-piperazinyl)-2-quinazolinamine IUPAC Name: N-benzyl-6-nitro-7-piperazin-1-ylquinazolin-2-amine Traditional Name: benzyl-(6-nitro-7-piperazino-quinazolin-2-yl)amine Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O2/c26-25(27)18-10-15-13-22-19(21-12-14-4-2-1-3-5-14)23-16(15)11-17(18)24-8-6-20-7-9-24/h1-5,10-11,13,20H,6-9,12H2,(H,21,22,23)