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

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-ylmethylamino)-6-quinazolinecarbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-ylmethylamino)quinazoline-6-carbonitrile Traditional Name: 2-amino-4-(piperonylamino)quinazoline-6-carbonitrile Formula: C17H13N5O2 MolecularWeight: 319.31742

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C17H13N5O2/c18-7-10-1-3-13-12(5-10)16(22-17(19)21-13)20-8-11-2-4-14-15(6-11)24-9-23-14/h1-6H,8-9H2,(H3,19,20,21,22)