N-(6-chloranyl-5-methylsulfanyl-2-piperidin-1-yl-pyrimidin-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrobromide

Systemtic Name: N-(6-chloranyl-5-methylsulfanyl-2-piperidin-1-yl-pyrimidin-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrobromide Openeye Name: N-[6-chloro-5-methylsulfanyl-2-(1-piperidyl)pyrimidin-4-yl]-N',N'-diisopropyl-ethane-1,2-diamine hydrobromide CAS Name: N-[6-chloro-5-(methylthio)-2-(1-piperidinyl)-4-pyrimidinyl]-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrobromide IUPAC Name: N-(6-chloro-5-methylsulfanyl-2-piperidin-1-ylpyrimidin-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrobromide Traditional Name: 2-[[6-chloro-5-(methylthio)-2-piperidino-pyrimidin-4-yl]amino]ethyl-diisopropyl-amine hydrobromide Formula: C18H33BrClN5S MolecularWeight: 466.91012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC1=C(C(=NC(=N1)N2CCCCC2)Cl)SC)C(C)C.Br

Isomeric SMILES

CC(C)N(CCNC1=C(C(=NC(=N1)N2CCCCC2)Cl)SC)C(C)C.Br

InChI

InChI=1S/C18H32ClN5S.BrH/c1-13(2)24(14(3)4)12-9-20-17-15(25-5)16(19)21-18(22-17)23-10-7-6-8-11-23;/h13-14H,6-12H2,1-5H3,(H,20,21,22);1H