Vitas-M small molecule compound

2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK292513
SMILES Cc1nnc(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 C17H10N4O5S MW 382.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10N4O5S/c1-9-18-19-17(27-9)20-15(22)13-6-5-12(8-14(13)16(20)23)26-11-4-2-3-10(7-11)21(24)25/h2-8H,1H3
InChIKey
UVFIWLXIMDVBBA-UHFFFAOYSA-N
Synonyms
402578-17-0
2(5methyl134thiadiazol2yl)5(3nitrophenoxy)1Hisoindole13(2H)dione
2(5METHYL134THIADIAZOL2YL)5(3NITROPHENOXY)ISOINDOLE13DIONE
2(5methyl134thiadiazol2yl)5(3nitrophenoxy)isoindoline13dione
402578170
CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)(N+)(=O)(O)
Cc1nnc(s1)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O)
InChI=1SC17H10N4O5Sc19181917(279)2015(22)136512(814(13)16(20)23)261142310(711)21(24)25h28H1H3
MFCD02031853
ZINC000001824226
ZINC01824226
ZINC1824226

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Available files

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