N',N'-diethyl-N-(8-nitro-3-thiophen-2-yl-quinoxalin-2-yl)butane-1,4-diamine

Systemtic Name: N',N'-diethyl-N-(8-nitro-3-thiophen-2-yl-quinoxalin-2-yl)butane-1,4-diamine Openeye Name: N',N'-diethyl-N-[8-nitro-3-(2-thienyl)quinoxalin-2-yl]butane-1,4-diamine CAS Name: N',N'-diethyl-N-(8-nitro-3-thiophen-2-yl-2-quinoxalinyl)butane-1,4-diamine IUPAC Name: N',N'-diethyl-N-(8-nitro-3-thiophen-2-ylquinoxalin-2-yl)butane-1,4-diamine Traditional Name: diethyl-[4-[[8-nitro-3-(2-thienyl)quinoxalin-2-yl]amino]butyl]amine Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCNC1=NC2=C(C=CC=C2[N+](=O)[O-])N=C1C3=CC=CS3

Isomeric SMILES

CCN(CC)CCCCNC1=NC2=C(C=CC=C2[N+](=O)[O-])N=C1C3=CC=CS3

InChI

InChI=1S/C20H25N5O2S/c1-3-24(4-2)13-6-5-12-21-20-19(17-11-8-14-28-17)22-15-9-7-10-16(25(26)27)18(15)23-20/h7-11,14H,3-6,12-13H2,1-2H3,(H,21,23)