2-imidazol-1-yl-6-nitro-N-(phenylmethyl)quinazolin-4-amine dichloride

Systemtic Name: 2-imidazol-1-yl-6-nitro-N-(phenylmethyl)quinazolin-4-amine dichloride Openeye Name: N-benzyl-2-imidazol-1-yl-6-nitro-quinazolin-4-amine dichloride CAS Name: 2-(1-imidazolyl)-6-nitro-N-(phenylmethyl)-4-quinazolinamine dichloride IUPAC Name: N-benzyl-2-imidazol-1-yl-6-nitroquinazolin-4-amine dichloride Traditional Name: benzyl-(2-imidazol-1-yl-6-nitro-quinazolin-4-yl)amine dichloride Formula: C18H14Cl2N6O2-2 MolecularWeight: 417.24876

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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-])N4C=CN=C4.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=C2C=C(C=C3)[N+](=O)[O-])N4C=CN=C4.[Cl-].[Cl-]

InChI

InChI=1S/C18H14N6O2.2ClH/c25-24(26)14-6-7-16-15(10-14)17(20-11-13-4-2-1-3-5-13)22-18(21-16)23-9-8-19-12-23;;/h1-10,12H,11H2,(H,20,21,22);2*1H/p-2