4-[[[2-azanyl-4-(methylamino)quinazolin-6-yl]-methyl-amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[2-azanyl-4-(methylamino)quinazolin-6-yl]-methyl-amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[2-amino-4-(methylamino)quinazolin-6-yl]-methyl-amino]methyl]benzonitrile CAS Name: 4-[[[2-amino-4-(methylamino)-6-quinazolinyl]-methylamino]methyl]benzonitrile IUPAC Name: 4-[[[2-amino-4-(methylamino)quinazolin-6-yl]-methylamino]methyl]benzonitrile Traditional Name: 4-[[[2-amino-4-(methylamino)quinazolin-6-yl]-methyl-amino]methyl]benzonitrile Formula: C18H18N6 MolecularWeight: 318.37572

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1C=C(C=C2)N(C)CC3=CC=C(C=C3)C#N)N

Isomeric SMILES

CNC1=NC(=NC2=C1C=C(C=C2)N(C)CC3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C18H18N6/c1-21-17-15-9-14(7-8-16(15)22-18(20)23-17)24(2)11-13-5-3-12(10-19)4-6-13/h3-9H,11H2,1-2H3,(H3,20,21,22,23)