Vitas-M small molecule compound
2-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK031972
SMILES CCSc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1
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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 C20H12N4O4S2 MW 436.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N4O4S2/c1-2-29-20-23-22-19(30-20)24-16(25)11-8-7-10(9-13(11)17(24)26)15-21-14-6-4-3-5-12(14)18(27)28-15/h3-9H,2H2,1H3InChIKey
FGBTYIYKUWHKQZ-UHFFFAOYSA-NSynonyms
2(5(ETHYLSULFANYL)134THIADIAZOL2YL)5(4OXO4H31BENZOXAZIN2YL)1HISOINDOLE13(2H)DIONE
2(5ETHYLSULFANYL134THIADIAZOL2YL)5(4OXO31BENZOXAZIN2YL)ISOINDOLE13DIONE
CCSC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5C(=O)O4
CCSc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1
InChI=1SC20H12N4O4S2c122920232219(3020)2416(25)118710(913(11)17(24)26)152114643512(14)18(27)2815h39H2H21H3
MFCD02031920
STK031972
ZINC000009144593
ZINC09144593
ZINC9144593
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