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

Systemtic Name: N4-[3-[5-chloranyl-1-(phenylmethyl)pyrazol-3-yl]quinoxalin-2-yl]-N1,N1-diethyl-pentane-1,4-diamine Openeye Name: N4-[3-(1-benzyl-5-chloro-pyrazol-3-yl)quinoxalin-2-yl]-N1,N1-diethyl-pentane-1,4-diamine CAS Name: N4-[3-[5-chloro-1-(phenylmethyl)-3-pyrazolyl]-2-quinoxalinyl]-N1,N1-diethylpentane-1,4-diamine IUPAC Name: 4-N-[3-(1-benzyl-5-chloropyrazol-3-yl)quinoxalin-2-yl]-1-N,1-N-diethylpentane-1,4-diamine Traditional Name: 4-[[3-(1-benzyl-5-chloro-pyrazol-3-yl)quinoxalin-2-yl]amino]pentyl-diethyl-amine Formula: C27H33ClN6 MolecularWeight: 477.04412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=NC2=CC=CC=C2N=C1C3=NN(C(=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCCC(C)NC1=NC2=CC=CC=C2N=C1C3=NN(C(=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C27H33ClN6/c1-4-33(5-2)17-11-12-20(3)29-27-26(30-22-15-9-10-16-23(22)31-27)24-18-25(28)34(32-24)19-21-13-7-6-8-14-21/h6-10,13-16,18,20H,4-5,11-12,17,19H2,1-3H3,(H,29,31)