Vitas-M small molecule compound
methyl 4,5-dimethoxy-2-({[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL021826
SMILES COC(=O)c1cc(OC)c(cc1NC(=O)CSc1nnnn1c1ccccc1)OC
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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 C19H19N5O5S MW 429.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O5S/c1-27-15-9-13(18(26)29-3)14(10-16(15)28-2)20-17(25)11-30-19-21-22-23-24(19)12-7-5-4-6-8-12/h4-10H,11H2,1-3H3,(H,20,25)InChIKey
CTZLVQFIUYRJSG-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CSC2=NN=NN2C3=CC=CC=C3)OC
InChI=1SC19H19N5O5Sc12715913(18(26)293)14(1016(15)282)2017(25)11301921222324(19)127546812h410H11H213H3(H2025)
methyl45dimethoxy2((((1phenyl1Htetrazol5yl)sulfanyl)acetyl)amino)benzoate
methyl45dimethoxy2((2(1phenyltetrazol5yl)sulfanylacetyl)amino)benzoate
MFCD07531422
ZINC000012292797
ZINC12292797
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