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

Systemtic Name: 4-(azepan-1-yl)-N-[1-(furan-2-ylmethyl)piperidin-4-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-(2-furylmethyl)-4-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-(2-furanylmethyl)-4-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-(furan-2-ylmethyl)piperidin-4-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-(2-furfuryl)-4-piperidyl]amine Formula: C20H29N5O MolecularWeight: 355.47716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(CC3)CC4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C20H29N5O/c1-2-4-12-25(11-3-1)19-7-10-21-20(23-19)22-17-8-13-24(14-9-17)16-18-6-5-15-26-18/h5-7,10,15,17H,1-4,8-9,11-14,16H2,(H,21,22,23)