2-[6,7-bis(chloranyl)-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]sulfanyl-N,N-diethyl-ethanamine

Systemtic Name: 2-[6,7-bis(chloranyl)-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]sulfanyl-N,N-diethyl-ethanamine Openeye Name: 2-(6,7-dichloro-3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-yl)sulfanyl-N,N-diethyl-ethanamine CAS Name: 2-[(6,7-dichloro-3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumyl)thio]-N,N-diethylethanamine IUPAC Name: 2-(6,7-dichloro-3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)sulfanyl-N,N-diethylethanamine Traditional Name: 2-[(6,7-dichloro-1-keto-3-methyl-4-oxido-quinoxalin-1-ium-2-yl)thio]ethyl-diethyl-amine Formula: C15H19Cl2N3O2S MolecularWeight: 376.30126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=C(N(C2=CC(=C(C=C2[N+]1=O)Cl)Cl)[O-])C

Isomeric SMILES

CCN(CC)CCSC1=C(N(C2=CC(=C(C=C2[N+]1=O)Cl)Cl)[O-])C

InChI

InChI=1S/C15H19Cl2N3O2S/c1-4-18(5-2)6-7-23-15-10(3)19(21)13-8-11(16)12(17)9-14(13)20(15)22/h8-9H,4-7H2,1-3H3