Vitas-M small molecule compound
methyl 2-({[(4-nitrobenzyl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL113181
SMILES COC(=O)c1c(NC(=O)CSCc2ccc(cc2)[N+](=O)[O-])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 C19H20N2O5S2 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5S2/c1-26-19(23)17-14-4-2-3-5-15(14)28-18(17)20-16(22)11-27-10-12-6-8-13(9-7-12)21(24)25/h6-9H,2-5,10-11H2,1H3,(H,20,22)InChIKey
LMCCBUWATCUOJW-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSCC3=CC=C(C=C3)(N+)(=O)(O)
COC(=O)c1c(NC(=O)CSCc2ccc(cc2)(N+)(=O)(O))sc2c1CCCC2
InChI=1SC19H20N2O5S2c12619(23)1714423515(14)2818(17)2016(22)112710126813(9712)21(24)25h69H251011H21H3(H2022)
methyl2((((4nitrobenzyl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2((4nitrophenyl)methylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD04210014
ZINC000002837766
ZINC02837766
ZINC2837766
Check stock
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