N-[4-(azepan-1-yl)pyrimidin-2-yl]-N'-methyl-N'-(phenylmethyl)ethane-1,2-diamine

Systemtic Name: N-[4-(azepan-1-yl)pyrimidin-2-yl]-N'-methyl-N'-(phenylmethyl)ethane-1,2-diamine Openeye Name: N-[4-(azepan-1-yl)pyrimidin-2-yl]-N'-benzyl-N'-methyl-ethane-1,2-diamine CAS Name: N-[4-(1-azepanyl)-2-pyrimidinyl]-N'-methyl-N'-(phenylmethyl)ethane-1,2-diamine IUPAC Name: N-[4-(azepan-1-yl)pyrimidin-2-yl]-N'-benzyl-N'-methylethane-1,2-diamine Traditional Name: 2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]ethyl-benzyl-methyl-amine Formula: C20H29N5 MolecularWeight: 339.47776

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNC1=NC=CC(=N1)N2CCCCCC2)CC3=CC=CC=C3

Isomeric SMILES

CN(CCNC1=NC=CC(=N1)N2CCCCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H29N5/c1-24(17-18-9-5-4-6-10-18)16-13-22-20-21-12-11-19(23-20)25-14-7-2-3-8-15-25/h4-6,9-12H,2-3,7-8,13-17H2,1H3,(H,21,22,23)