6-nitro-N-(phenylmethyl)-2-pyridin-4-yl-quinazolin-4-amine

Systemtic Name: 6-nitro-N-(phenylmethyl)-2-pyridin-4-yl-quinazolin-4-amine Openeye Name: N-benzyl-6-nitro-2-(4-pyridyl)quinazolin-4-amine CAS Name: 6-nitro-N-(phenylmethyl)-2-pyridin-4-yl-4-quinazolinamine IUPAC Name: N-benzyl-6-nitro-2-pyridin-4-ylquinazolin-4-amine Traditional Name: benzyl-[6-nitro-2-(4-pyridyl)quinazolin-4-yl]amine Formula: C20H15N5O2 MolecularWeight: 357.3654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4

InChI

InChI=1S/C20H15N5O2/c26-25(27)16-6-7-18-17(12-16)20(22-13-14-4-2-1-3-5-14)24-19(23-18)15-8-10-21-11-9-15/h1-12H,13H2,(H,22,23,24)