1-[4-(2-azanylquinazolin-4-yl)piperidin-1-yl]-2-(1,3-benzodioxol-5-yl)ethanone

Systemtic Name: 1-[4-(2-azanylquinazolin-4-yl)piperidin-1-yl]-2-(1,3-benzodioxol-5-yl)ethanone Openeye Name: 1-[4-(2-aminoquinazolin-4-yl)-1-piperidyl]-2-(1,3-benzodioxol-5-yl)ethanone CAS Name: 1-[4-(2-amino-4-quinazolinyl)-1-piperidinyl]-2-(1,3-benzodioxol-5-yl)ethanone IUPAC Name: 1-[4-(2-aminoquinazolin-4-yl)piperidin-1-yl]-2-(1,3-benzodioxol-5-yl)ethanone Traditional Name: 1-[4-(2-aminoquinazolin-4-yl)piperidino]-2-(1,3-benzodioxol-5-yl)ethanone Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=NC3=CC=CC=C32)N)C(=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1C2=NC(=NC3=CC=CC=C32)N)C(=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N4O3/c23-22-24-17-4-2-1-3-16(17)21(25-22)15-7-9-26(10-8-15)20(27)12-14-5-6-18-19(11-14)29-13-28-18/h1-6,11,15H,7-10,12-13H2,(H2,23,24,25)