N2-(1H-benzimidazol-2-ylmethyl)-6,7-dimethoxy-quinazoline-2,4-diamine

Systemtic Name: N2-(1H-benzimidazol-2-ylmethyl)-6,7-dimethoxy-quinazoline-2,4-diamine Openeye Name: N2-(1H-benzimidazol-2-ylmethyl)-6,7-dimethoxy-quinazoline-2,4-diamine CAS Name: N2-(1H-benzimidazol-2-ylmethyl)-6,7-dimethoxyquinazoline-2,4-diamine IUPAC Name: 2-N-(1H-benzimidazol-2-ylmethyl)-6,7-dimethoxyquinazoline-2,4-diamine Traditional Name: (4-amino-6,7-dimethoxy-quinazolin-2-yl)-(1H-benzimidazol-2-ylmethyl)amine Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NCC3=NC4=CC=CC=C4N3)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NCC3=NC4=CC=CC=C4N3)N)OC

InChI

InChI=1S/C18H18N6O2/c1-25-14-7-10-13(8-15(14)26-2)23-18(24-17(10)19)20-9-16-21-11-5-3-4-6-12(11)22-16/h3-8H,9H2,1-2H3,(H,21,22)(H3,19,20,23,24)