N7-methyl-N4-(3-methylphenyl)-6-nitro-quinazoline-4,7-diamine

Systemtic Name: N7-methyl-N4-(3-methylphenyl)-6-nitro-quinazoline-4,7-diamine Openeye Name: N7-methyl-N4-(m-tolyl)-6-nitro-quinazoline-4,7-diamine CAS Name: N7-methyl-N4-(3-methylphenyl)-6-nitroquinazoline-4,7-diamine IUPAC Name: 7-N-methyl-4-N-(3-methylphenyl)-6-nitroquinazoline-4,7-diamine Traditional Name: methyl-[4-(m-toluidino)-6-nitro-quinazolin-7-yl]amine Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])NC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])NC

InChI

InChI=1S/C16H15N5O2/c1-10-4-3-5-11(6-10)20-16-12-7-15(21(22)23)14(17-2)8-13(12)18-9-19-16/h3-9,17H,1-2H3,(H,18,19,20)