(7E)-4-oxidanidyl-1-oxidanyl-N,3-diphenyl-7-[(prop-2-enylcarbamothioyldiazenyl)methylidene]quinoxalin-4-ium-2-carboxamide

Systemtic Name: (7E)-4-oxidanidyl-1-oxidanyl-N,3-diphenyl-7-[(prop-2-enylcarbamothioyldiazenyl)methylidene]quinoxalin-4-ium-2-carboxamide Openeye Name: (7E)-7-(allylcarbamothioylazomethylene)-1-hydroxy-4-oxido-N,3-diphenyl-quinoxalin-4-ium-2-carboxamide CAS Name: (7E)-1-hydroxy-4-oxido-N,3-diphenyl-7-[[(prop-2-enylamino)-sulfanylidenemethyl]azomethylidene]-2-quinoxalin-4-iumcarboxamide IUPAC Name: (7E)-1-hydroxy-4-oxido-N,3-diphenyl-7-[(prop-2-enylcarbamothioyldiazenyl)methylidene]quinoxalin-4-ium-2-carboxamide Traditional Name: (7E)-7-(allylthiocarbamoylazomethylene)-1-hydroxy-4-oxido-N,3-diphenyl-quinoxalin-4-ium-2-carboxamide Formula: C26H22N6O3S MolecularWeight: 498.55628

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N=NC=C1C=CC2=[N+](C(=C(N(C2=C1)O)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

C=CCNC(=S)N=N/C=C/1\C=CC2=[N+](C(=C(N(C2=C1)O)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C26H22N6O3S/c1-2-15-27-26(36)30-28-17-18-13-14-21-22(16-18)32(35)24(25(33)29-20-11-7-4-8-12-20)23(31(21)34)19-9-5-3-6-10-19/h2-14,16-17,35H,1,15H2,(H,27,36)(H,29,33)/b18-17+,30-28?