N-[2-(3-azanylpropyl)-1-cyclohexyl-pyrrolidin-3-yl]-4-(azepan-1-yl)pyrimidin-2-amine

Systemtic Name: N-[2-(3-azanylpropyl)-1-cyclohexyl-pyrrolidin-3-yl]-4-(azepan-1-yl)pyrimidin-2-amine Openeye Name: N-[2-(3-aminopropyl)-1-cyclohexyl-pyrrolidin-3-yl]-4-(azepan-1-yl)pyrimidin-2-amine CAS Name: N-[2-(3-aminopropyl)-1-cyclohexyl-3-pyrrolidinyl]-4-(1-azepanyl)-2-pyrimidinamine IUPAC Name: N-[2-(3-aminopropyl)-1-cyclohexylpyrrolidin-3-yl]-4-(azepan-1-yl)pyrimidin-2-amine Traditional Name: [2-(3-aminopropyl)-1-cyclohexyl-pyrrolidin-3-yl]-[4-(azepan-1-yl)pyrimidin-2-yl]amine Formula: C23H40N6 MolecularWeight: 400.6039

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(C3CCCN)C4CCCCC4

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(C3CCCN)C4CCCCC4

InChI

InChI=1S/C23H40N6/c24-14-8-11-21-20(13-18-29(21)19-9-4-3-5-10-19)26-23-25-15-12-22(27-23)28-16-6-1-2-7-17-28/h12,15,19-21H,1-11,13-14,16-18,24H2,(H,25,26,27)