4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6-quinazolinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile Traditional Name: 4-(piperonylamino)quinazoline-6-carbonitrile Formula: C17H12N4O2 MolecularWeight: 304.30278

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC4=C3C=C(C=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C17H12N4O2/c18-7-11-1-3-14-13(5-11)17(21-9-20-14)19-8-12-2-4-15-16(6-12)23-10-22-15/h1-6,9H,8,10H2,(H,19,20,21)