4-(azepan-1-yl)-N-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-(2,2-dimethoxyethyl)-3-pyrrolidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]amine Formula: C18H31N5O2 MolecularWeight: 349.47104

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1CCC(C1)NC2=NC=CC(=N2)N3CCCCCC3)OC

Isomeric SMILES

COC(CN1CCC(C1)NC2=NC=CC(=N2)N3CCCCCC3)OC

InChI

InChI=1S/C18H31N5O2/c1-24-17(25-2)14-22-12-8-15(13-22)20-18-19-9-7-16(21-18)23-10-5-3-4-6-11-23/h7,9,15,17H,3-6,8,10-14H2,1-2H3,(H,19,20,21)