N-(3-chloranyl-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)-N',N'-diethyl-butane-1,4-diamine

Systemtic Name: N-(3-chloranyl-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)-N',N'-diethyl-butane-1,4-diamine Openeye Name: N-(3-chloro-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)-N',N'-diethyl-butane-1,4-diamine CAS Name: N-(3-chloro-1-methyl-6-pyrazolo[3,4-d]pyrimidinyl)-N',N'-diethylbutane-1,4-diamine IUPAC Name: N-(3-chloro-1-methylpyrazolo[3,4-d]pyrimidin-6-yl)-N',N'-diethylbutane-1,4-diamine Traditional Name: 4-[(3-chloro-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)amino]butyl-diethyl-amine Formula: C14H23ClN6 MolecularWeight: 310.82562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCNC1=NC=C2C(=N1)N(N=C2Cl)C

Isomeric SMILES

CCN(CC)CCCCNC1=NC=C2C(=N1)N(N=C2Cl)C

InChI

InChI=1S/C14H23ClN6/c1-4-21(5-2)9-7-6-8-16-14-17-10-11-12(15)19-20(3)13(11)18-14/h10H,4-9H2,1-3H3,(H,16,17,18)