Vitas-M small molecule compound

4-({[1-(naphthalen-1-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)benzoic acid

Catalog ID
STK793237
SMILES OC(=O)c1ccc(cc1)CSc1nnnn1c1cccc2c1cccc2

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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 C19H14N4O2S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N4O2S/c24-18(25)15-10-8-13(9-11-15)12-26-19-20-21-22-23(19)17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12H2,(H,24,25)
InChIKey
GJTOUDCUNLVDCJ-UHFFFAOYSA-N
Synonyms
634168-78-8
4(((1(1NAPHTHYL)1HTETRAAZOL5YL)SULFANYL)METHYL)BENZOICACID
4(((1(naphthalen1yl)1Htetrazol5yl)sulfanyl)methyl)benzoicacid
4(((1(naphthalen1yl)1Htetrazol5yl)thio)methyl)benzoicacid
4((1NAPHTHALEN1YLTETRAZOL5YL)SULFANYLMETHYL)BENZOICACID
634168788
C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCC4=CC=C(C=C4)C(=O)O
InChI=1SC19H14N4O2Sc2418(25)1510813(91115)12261920212223(19)1773514412616(14)17h111H12H2(H2425)
MFCD03820067
ZINC000000679632
ZINC679632

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Available files

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