Vitas-M small molecule compound
propyl 2-{[(2E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK316950
SMILES CCCOC(=O)c1c(NC(=O)/C=C/c2ccc(o2)[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 C19H20N2O6S MW 404.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O6S/c1-2-11-26-19(23)17-13-5-3-4-6-14(13)28-18(17)20-15(22)9-7-12-8-10-16(27-12)21(24)25/h7-10H,2-6,11H2,1H3,(H,20,22)/b9-7+InChIKey
OIEOGOUDFOOSAV-VQHVLOKHSA-NSynonyms
515175-67-4515175674
CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=C(O3)(N+)(=O)(O)
CCCOC(=O)c1c(NC(=O)C=Cc2ccc(o2)(N+)(=O)(O))sc2c1CCCC2
InChI=1SC19H20N2O6Sc12112619(23)1713534614(13)2818(17)2015(22)971281016(2712)21(24)25h710H2611H21H3(H2022)b97+
MFCD03758524
propyl2(((2E)3(5nitrofuran2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propyl2(((E)3(5nitrofuran2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002764044
ZINC02764044
ZINC2764044
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