Vitas-M small molecule compound
methyl 2-({[1-(1,3-benzodioxol-5-yl)ethyl]carbamothioyl}amino)-5-ethylthiophene-3-carboxylate
Catalog ID
STK472773
SMILES COC(=O)c1cc(sc1NC(=S)NC(c1ccc2c(c1)OCO2)C)CC
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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 C18H20N2O4S2 MW 392.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S2/c1-4-12-8-13(17(21)22-3)16(26-12)20-18(25)19-10(2)11-5-6-14-15(7-11)24-9-23-14/h5-8,10H,4,9H2,1-3H3,(H2,19,20,25)InChIKey
SNEPRCSWSODEDE-UHFFFAOYSA-NSynonyms
CCC1=CC(=C(S1)NC(=S)NC(C)C2=CC3=C(C=C2)OCO3)C(=O)OC
InChI=1SC18H20N2O4S2c1412813(17(21)223)16(2612)2018(25)1910(2)11561415(711)2492314h5810H49H213H3(H2192025)
METHYL2((((2HBENZO(34D)13DIOXOLEN5YLETHYL)AMINO)THIOXOMETHYL)AMINO)5ETHYLTHIOPHENE3CARBOXYLATE
methyl2(((1(13benzodioxol5yl)ethyl)carbamothioyl)amino)5ethylthiophene3carboxylate
methyl2(1(13benzodioxol5yl)ethylcarbamothioylamino)5ethylthiophene3carboxylate
MFCD07078662
ZINC000017080194
ZINC000017080195
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