4-[(4-azanylquinazolin-2-yl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-[(4-azanylquinazolin-2-yl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carboxamide Openeye Name: 4-[(4-aminoquinazolin-2-yl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carboxamide CAS Name: 4-[(4-amino-2-quinazolinyl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-1-piperazinecarboxamide IUPAC Name: 4-[(4-aminoquinazolin-2-yl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carboxamide Traditional Name: 4-[(4-aminoquinazolin-2-yl)methyl]-N-piperonyl-piperazine-1-carboxamide Formula: C22H24N6O3 MolecularWeight: 420.46436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H24N6O3/c23-21-16-3-1-2-4-17(16)25-20(26-21)13-27-7-9-28(10-8-27)22(29)24-12-15-5-6-18-19(11-15)31-14-30-18/h1-6,11H,7-10,12-14H2,(H,24,29)(H2,23,25,26)