Vitas-M small molecule compound
4-(5-{[(2-methylnaphthalen-1-yl)methyl]sulfanyl}-1H-tetrazol-1-yl)benzoic acid
Catalog ID
STK675680
SMILES Cc1ccc2c(c1CSc1nnnn1c1ccc(cc1)C(=O)O)cccc2
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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 C20H16N4O2S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O2S/c1-13-6-7-14-4-2-3-5-17(14)18(13)12-27-20-21-22-23-24(20)16-10-8-15(9-11-16)19(25)26/h2-11H,12H2,1H3,(H,25,26)InChIKey
LZWGDNRALBUFQC-UHFFFAOYSA-NSynonyms
4(5(((2METHYLNAPHTHALEN1YL)METHYL)SULFANYL)1HTETRAZOL1YL)BENZOICACID
4(5((2METHYLNAPHTHALEN1YL)METHYLSULFANYL)TETRAZOL1YL)BENZOICACID
CC1=C(C2=CC=CC=C2C=C1)CSC3=NN=NN3C4=CC=C(C=C4)C(=O)O
InChI=1SC20H16N4O2Sc1136714423517(14)18(13)12272021222324(20)1610815(91116)19(25)26h211H12H21H3(H2526)
MFCD01580913
ZINC000001064683
ZINC1064683
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