Vitas-M small molecule compound
3-{2-[(3-sulfopropyl)sulfanyl]-1,3-benzothiazol-3-ium-3-yl}propane-1-sulfonate
Catalog ID
STK396448
SMILES [O-]S(=O)(=O)CCC[n+]1c(SCCCS(=O)(=O)O)sc2c1cccc2
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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 C13H17NO6S4 MW 411.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO6S4/c15-23(16,17)9-3-7-14-11-5-1-2-6-12(11)22-13(14)21-8-4-10-24(18,19)20/h1-2,5-6H,3-4,7-10H2,(H-,15,16,17,18,19,20)InChIKey
QADFRFVGUNDHAD-UHFFFAOYSA-NSynonyms
110208-16-7(O)S(=O)(=O)CCC(n+)1c(SCCCS(=O)(=O)O)sc2c1cccc2
2((3SULFONATOPROPYL)SULFANYL)3(3SULFOPROPYL)13BENZOTHIAZOL3IUM
3((3(3SULFOPROPYL)13BENZOTHIAZOL3IUM2YL)SULFANYL)PROPANE1SULFONATE
3(2((3sulfopropyl)sulfanyl)13benzothiazol3ium3yl)propane1sulfonate
3(2((3SULFOPROPYL)THIO)BENZO(D)THIAZOL3IUM3YL)PROPANE1SULFONATE
3(2(3SULFOPROPYLSULFANYL)13BENZOTHIAZOL3IUM3YL)PROPANE1SULFONATE
3(2(3SULFOPROPYLTHIO)BENZOTHIAZOL3YL)PROPANESULFONICACID
BENZOTHIAZOLIUM3(3SULFOPROPYL)2((3SULFOPROPYL)THIO)INNERSALT
C1=CC=C2C(=C1)(N+)(=C(S2)SCCCS(=O)(=O)O)CCCS(=O)(=O)(O)
InChI=1SC13H17NO6S4c1523(1617)9371411512612(11)2213(14)21841024(1819)20h1256H34710H2(H151617181920)
MFCD00227241
ZINC000001880968
Check stock
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Check stock on Vitas-MAvailable files
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