Vitas-M small molecule compound
2-[({[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Catalog ID
STL495708
SMILES COc1ccc(cc1)n1nnnc1SCC(=O)Nc1sc2c(c1C(=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 C19H19N5O4S2 MW 445.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O4S2/c1-28-12-8-6-11(7-9-12)24-19(21-22-23-24)29-10-15(25)20-17-16(18(26)27)13-4-2-3-5-14(13)30-17/h6-9H,2-5,10H2,1H3,(H,20,25)(H,26,27)InChIKey
ILEWUNRBHVDAFW-UHFFFAOYSA-NSynonyms
2((((1(4methoxyphenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
2((2(1(4methoxyphenyl)tetrazol5yl)sulfanylacetyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
COC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)O
InChI=1SC19H19N5O4S2c128128611(7912)2419(21222324)291015(25)201716(18(26)27)13423514(13)3017h69H2510H21H3(H2025)(H2627)
MFCD05041893
ZINC000016226403
ZINC16226403
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