Vitas-M small molecule compound
methyl 2-[({[1-(naphthalen-1-yl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL025274
SMILES COC(=O)c1ccccc1NC(=O)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 C21H17N5O3S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3S/c1-29-20(28)16-10-4-5-11-17(16)22-19(27)13-30-21-23-24-25-26(21)18-12-6-8-14-7-2-3-9-15(14)18/h2-12H,13H2,1H3,(H,22,27)InChIKey
GBAYBGYXICJFDX-UHFFFAOYSA-NSynonyms
634168-75-5634168755
BENZOICACID2((((1(1NAPHTHALENYL)1HTETRAZOL5YL)THIO)ACETYL)AMINO)METHYLESTER
COC(=O)C1=CC=CC=C1NC(=O)CSC2=NN=NN2C3=CC=CC4=CC=CC=C43
InChI=1SC21H17N5O3Sc12920(28)1610451117(16)2219(27)13302123242526(21)18126814723915(14)18h212H13H21H3(H2227)
METHYL2((((1(1NAPHTHYL)1HTETRAAZOL5YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl2((((1(naphthalen1yl)1Htetrazol5yl)sulfanyl)acetyl)amino)benzoate
METHYL2((2(1(1NAPHTHYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)BENZOATE
METHYL2((2(1NAPHTHALEN1YLTETRAZOL5YL)SULFANYLACETYL)AMINO)BENZOATE
methyl2(2((1(naphthalen1yl)1Htetrazol5yl)thio)acetamido)benzoate
METHYL2(2(1(NAPHTHALEN1YL)1HTETRAZOL5YLTHIO)ACETAMIDO)BENZOATE
MFCD03820066
ZINC000000679631
ZINC00679631
ZINC679631
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.