Vitas-M small molecule compound
3-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}propanoic acid
Catalog ID
STK379595
SMILES OC(=O)CCSc1nc2c(s1)cc(cc2)N1C(=O)c2c(C1=O)cccc2
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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 C18H12N2O4S2 MW 384.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N2O4S2/c21-15(22)7-8-25-18-19-13-6-5-10(9-14(13)26-18)20-16(23)11-3-1-2-4-12(11)17(20)24/h1-6,9H,7-8H2,(H,21,22)InChIKey
ZBOPIODORYUGDW-UHFFFAOYSA-NSynonyms
3((6(13dioxo13dihydro2Hisoindol2yl)13benzothiazol2yl)sulfanyl)propanoicacid
3((6(13DIOXOISOINDOL2YL)13BENZOTHIAZOL2YL)SULFANYL)PROPANOICACID
3(6(13DIOXOBENZO(C)AZOLIN2YL)BENZOTHIAZOL2YLTHIO)PROPANOICACID
C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC4=C(C=C3)N=C(S4)SCCC(=O)O
InChI=1SC18H12N2O4S2c2115(22)78251819136510(914(13)2618)2016(23)11312412(11)17(20)24h169H78H2(H2122)
MFCD02104167
ZINC000001208084
ZINC1208084
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