Vitas-M small molecule compound

3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Catalog ID
STK442019
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)Nc1nnc(s1)C

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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 C11H11N3O4S MW 281.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O4S/c1-4-13-14-11(19-4)12-9(15)7-5-2-3-6(18-5)8(7)10(16)17/h2-3,5-8H,1H3,(H,16,17)(H,12,14,15)
InChIKey
NQNCLYCHYSUUSL-UHFFFAOYSA-N
Synonyms

2(((5METHYL134THIADIAZOL2YL)AMINO)OXOMETHYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
2((5METHYL134THIADIAZOL2YL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3(((5METHYL134THIADIAZOL2YL)AMINO)CARBONYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((5methyl134thiadiazol2yl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(N(5METHYL134THIADIAZOL2YL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
CC1=NN=C(S1)NC(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC11H11N3O4Sc14131411(194)129(15)75236(185)8(7)10(16)17h2358H1H3(H1617)(H121415)
MFCD03381508
ZINC000169296789
ZINC000239165178

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Available files

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