Vitas-M small molecule compound
ethyl 2-({[4-(1H-tetrazol-1-yl)phenyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK731917
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)n2cnnn2)sc2c1CCCC2
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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 C19H19N5O3S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O3S/c1-2-27-19(26)16-14-5-3-4-6-15(14)28-18(16)21-17(25)12-7-9-13(10-8-12)24-11-20-22-23-24/h7-11H,2-6H2,1H3,(H,21,25)InChIKey
FHUIDUXZHWZMJE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=C(C=C3)N4C=NN=N4
ethyl2(((4(1Htetrazol1yl)phenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4(tetrazol1yl)benzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H19N5O3Sc122719(26)1614534615(14)2818(16)2117(25)127913(10812)241120222324h711H26H21H3(H2125)
MFCD02591594
ZINC000001068141
ZINC01068141
ZINC1068141
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