Vitas-M small molecule compound
2-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK292503
SMILES CCc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(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 C18H12N4O5S MW 396.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N4O5S/c1-2-15-19-20-18(28-15)21-16(23)13-7-6-12(9-14(13)17(21)24)27-11-5-3-4-10(8-11)22(25)26/h3-9H,2H2,1H3InChIKey
RXBMBHCFSNBLLM-UHFFFAOYSA-NSynonyms
402579-52-62(5ethyl134thiadiazol2yl)5(3nitrophenoxy)1Hisoindole13(2H)dione
2(5ETHYL134THIADIAZOL2YL)5(3NITROPHENOXY)ISOINDOLE13DIONE
2(5ethyl134thiadiazol2yl)5(3nitrophenoxy)isoindoline13dione
402579526
CCC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)(N+)(=O)(O)
CCc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O)
InChI=1SC18H12N4O5Sc1215192018(2815)2116(23)137612(914(13)17(21)24)271153410(811)22(25)26h39H2H21H3
MFCD02031749
ZINC000004311454
ZINC04311454
ZINC4311454
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