N4-[3-(5-chloranyl-1H-pyrazol-3-yl)quinoxalin-2-yl]-N1,N1-diethyl-pentane-1,4-diamine

Systemtic Name: N4-[3-(5-chloranyl-1H-pyrazol-3-yl)quinoxalin-2-yl]-N1,N1-diethyl-pentane-1,4-diamine Openeye Name: N4-[3-(5-chloro-1H-pyrazol-3-yl)quinoxalin-2-yl]-N1,N1-diethyl-pentane-1,4-diamine CAS Name: N4-[3-(5-chloro-1H-pyrazol-3-yl)-2-quinoxalinyl]-N1,N1-diethylpentane-1,4-diamine IUPAC Name: 4-N-[3-(5-chloro-1H-pyrazol-3-yl)quinoxalin-2-yl]-1-N,1-N-diethylpentane-1,4-diamine Traditional Name: 4-[[3-(5-chloro-1H-pyrazol-3-yl)quinoxalin-2-yl]amino]pentyl-diethyl-amine Formula: C20H27ClN6 MolecularWeight: 386.92158

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=NC2=CC=CC=C2N=C1C3=NNC(=C3)Cl

Isomeric SMILES

CCN(CC)CCCC(C)NC1=NC2=CC=CC=C2N=C1C3=NNC(=C3)Cl

InChI

InChI=1S/C20H27ClN6/c1-4-27(5-2)12-8-9-14(3)22-20-19(17-13-18(21)26-25-17)23-15-10-6-7-11-16(15)24-20/h6-7,10-11,13-14H,4-5,8-9,12H2,1-3H3,(H,22,24)(H,25,26)