Vitas-M small molecule compound

2-(1H-tetrazol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Catalog ID
STK802427
SMILES OC(=O)c1c(sc2c1CCCC2)n1cnnn1

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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 C10H10N4O2S MW 250.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N4O2S/c15-10(16)8-6-3-1-2-4-7(6)17-9(8)14-5-11-12-13-14/h5H,1-4H2,(H,15,16)
InChIKey
BNYWHMYYSYIHDL-UHFFFAOYSA-N
Synonyms
461457-23-8
2(1Htetrazol1yl)4567tetrahydro1benzothiophene3carboxylicacid
2(1Htetrazol1yl)4567tetrahydrobenzo(b)thiophene3carboxylicacid
2(tetrazol1yl)4567tetrahydro1benzothiophene3carboxylicacid
461457238
C1CCC2=C(C1)C(=C(S2)N3C=NN=N3)C(=O)O
InChI=1SC10H10N4O2Sc1510(16)8631247(6)179(8)14511121314h5H14H2(H1516)
MFCD03123671
ZINC000000414957
ZINC414957

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.