Vitas-M small molecule compound
2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Catalog ID
STK092181
SMILES O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1nc2c(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 C23H14N4O5S2 MW 490.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14N4O5S2/c28-20(24-13-4-3-5-15(10-13)27(31)32)12-33-23-25-18-9-8-14(11-19(18)34-23)26-21(29)16-6-1-2-7-17(16)22(26)30/h1-11H,12H2,(H,24,28)InChIKey
JAIDJODOQMFXHT-UHFFFAOYSA-NSynonyms
2((6(13DIOXO13DIHYDRO2HISOINDOL2YL)13BENZOTHIAZOL2YL)SULFANYL)N(3NITROPHENYL)ACETAMIDE
2((6(13DIOXOISOINDOL2YL)13BENZOTHIAZOL2YL)SULFANYL)N(3NITROPHENYL)ACETAMIDE
C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC4=C(C=C3)N=C(S4)SCC(=O)NC5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC23H14N4O5S2c2820(241343515(1013)27(31)32)12332325189814(1119(18)3423)2621(29)16612717(16)22(26)30h111H12H2(H2428)
MFCD00760573
O=C(Nc1cccc(c1)(N+)(=O)(O))CSc1nc2c(s1)cc(cc2)N1C(=O)c2c(C1=O)cccc2
STK092181
ZINC000002889789
ZINC02889789
ZINC2889789
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