Vitas-M small molecule compound
2-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[(3-nitrophenyl)carbonyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK224643
SMILES CCc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)c1cccc(c1)[N+](=O)[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 C19H12N4O5S MW 408.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N4O5S/c1-2-15-20-21-19(29-15)22-17(25)13-7-6-11(9-14(13)18(22)26)16(24)10-4-3-5-12(8-10)23(27)28/h3-9H,2H2,1H3InChIKey
KUWUGPQSKQWUSX-UHFFFAOYSA-NSynonyms
2(5ethyl134thiadiazol2yl)5((3nitrophenyl)carbonyl)1Hisoindole13(2H)dione
2(5ETHYL134THIADIAZOL2YL)5(3NITROBENZOYL)1HISOINDOLE13(2H)DIONE
2(5ETHYL134THIADIAZOL2YL)5(3NITROBENZOYL)ISOINDOLE13DIONE
CCC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC(=CC=C4)(N+)(=O)(O)
CCc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC19H12N4O5Sc1215202119(2915)2217(25)137611(914(13)18(22)26)16(24)1043512(810)23(27)28h39H2H21H3
MFCD03780685
ZINC000002835603
ZINC02835603
ZINC2835603
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