Vitas-M small molecule compound
4-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl thiophene-2-carboxylate
Catalog ID
STK177469
SMILES [O-][N+](=O)c1ccc(cc1)c1nnc(o1)SCC#CCOC(=O)c1cccs1
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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 C17H11N3O5S2 MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11N3O5S2/c21-16(14-4-3-11-26-14)24-9-1-2-10-27-17-19-18-15(25-17)12-5-7-13(8-6-12)20(22)23/h3-8,11H,9-10H2InChIKey
LDPWBZHHZYNLBW-UHFFFAOYSA-NSynonyms
669715-78-0(O)(N+)(=O)c1ccc(cc1)c1nnc(o1)SCC#CCOC(=O)c1cccs1
4((5(4NITROPHENYL)134OXADIAZOL2YL)SULFANYL)BUT2YN1YLTHIOPHENE2CARBOXYLATE
4((5(4NITROPHENYL)134OXADIAZOL2YL)SULFANYL)BUT2YNYLTHIOPHENE2CARBOXYLATE
4((5(4NITROPHENYL)134OXADIAZOL2YL)THIO)2BUTYN1YL2THIOPHENECARBOXYLATE
4((5(4nitrophenyl)134oxadiazol2yl)thio)but2yn1ylthiophene2carboxylate
669715780
C1=CSC(=C1)C(=O)OCC#CCSC2=NN=C(O2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H11N3O5S2c2116(1443112614)24912102717191815(2517)125713(8612)20(22)23h3811H910H2
MFCD03667477
ZINC000002194964
ZINC02194964
ZINC2194964
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