Vitas-M small molecule compound
methyl 3-[({[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]thiophene-2-carboxylate
Catalog ID
STK743717
SMILES COC(=O)c1sccc1NC(=O)CSc1nnnn1c1ccc2c(c1)OCO2
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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 C16H13N5O5S2 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N5O5S2/c1-24-15(23)14-10(4-5-27-14)17-13(22)7-28-16-18-19-20-21(16)9-2-3-11-12(6-9)26-8-25-11/h2-6H,7-8H2,1H3,(H,17,22)InChIKey
PSYJGUWNWOWKQB-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=CS1)NC(=O)CSC2=NN=NN2C3=CC4=C(C=C3)OCO4
InChI=1SC16H13N5O5S2c12415(23)1410(452714)1713(22)7281618192021(16)9231112(69)2682511h26H78H21H3(H1722)
methyl3((((1(13benzodioxol5yl)1Htetrazol5yl)sulfanyl)acetyl)amino)thiophene2carboxylate
METHYL3((2(1(13BENZODIOXOL5YL)TETRAZOL5YL)SULFANYLACETYL)AMINO)THIOPHENE2CARBOXYLATE
MFCD05854648
ZINC000002866189
ZINC02866189
ZINC2866189
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