Vitas-M small molecule compound
[(3-benzyl-7'-nitro-5'H-spiro[cyclohepta[d][1,3]thiazol-3-ium-2,8'-quinolin]-5'-ylidene)(oxido)-lambda~5~-azanyl]oxidanide
Catalog ID
STK535782
SMILES [O-][N+](=C1C=C([N+](=O)[O-])C2(c3c1cccn3)SC1=CC=CC=CC1=[N+]2Cc1ccccc1)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H16N4O4S MW 444.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O4S/c28-26(29)19-14-21(27(30)31)23(22-17(19)10-7-13-24-22)25(15-16-8-3-1-4-9-16)18-11-5-2-6-12-20(18)32-23/h1-14H,15H2InChIKey
MQPNUFHIOQJVIG-UHFFFAOYSA-NSynonyms
((3benzyl7nitro5Hspiro(cyclohepta(d)(13)thiazol3ium28quinolin)5ylidene)(oxido)lambda~5~azanyl)oxidanide
((3BENZYL7NITRO5HSPIRO(CYCLOHEPTA(D)(13)THIAZOL3IUM28QUINOLIN)5YLIDENE)(OXIDO)LAMBDA5AZANYL)OXIDANIDE
(3benzyl7nitro5Hspiro(cyclohepta(d)thiazole28quinolin)5ylidene3ium)azinate
(3BENZYL7NITROSPIRO(CYCLOHEPTA(D)(13)THIAZOL3IUM28QUINOLINE)5YLIDENE)DIOXIDOAZANIUM
(O)(N+)(=C1C=C((N+)(=O)(O))C2(c3c1cccn3)SC1=CC=CC=CC1=(N+)2Cc1ccccc1)(O)
C1=CC=C(C=C1)C(N+)2=C3C=CC=CC=C3SC24C(=CC(=(N+)((O))(O))C5=C4N=CC=C5)(N+)(=O)(O)
InChI=1SC23H16N4O4Sc2826(29)191421(27(30)31)23(2217(19)107132422)25(15168314916)18115261220(18)3223h114H15H2
MFCD01857482
ZINC000009271799
ZINC000009271800
Check stock
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Check stock on Vitas-MAvailable files
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