N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-6-piperidin-3-yl-pyrimidin-4-amine

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-6-piperidin-3-yl-pyrimidin-4-amine Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-6-(3-piperidyl)pyrimidin-4-amine CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-6-(3-piperidinyl)-4-pyrimidinamine IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-6-piperidin-3-ylpyrimidin-4-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl-[6-(3-piperidyl)pyrimidin-4-yl]amine Formula: C19H24N4O2 MolecularWeight: 340.41946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=CC(=NC=N2)NCC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(CNC1)C2=CC(=NC=N2)NCC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H24N4O2/c1-3-15(12-20-6-1)16-10-19(23-13-22-16)21-11-14-4-5-17-18(9-14)25-8-2-7-24-17/h4-5,9-10,13,15,20H,1-3,6-8,11-12H2,(H,21,22,23)