4-(azepan-1-yl)-N-[1-(1-benzofuran-2-ylmethyl)piperidin-4-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[1-(1-benzofuran-2-ylmethyl)piperidin-4-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-(benzofuran-2-ylmethyl)-4-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-(2-benzofuranylmethyl)-4-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-(1-benzofuran-2-ylmethyl)piperidin-4-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-(benzofuran-2-ylmethyl)-4-piperidyl]amine Formula: C24H31N5O MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(CC3)CC4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(CC3)CC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C24H31N5O/c1-2-6-14-29(13-5-1)23-9-12-25-24(27-23)26-20-10-15-28(16-11-20)18-21-17-19-7-3-4-8-22(19)30-21/h3-4,7-9,12,17,20H,1-2,5-6,10-11,13-16,18H2,(H,25,26,27)