Vitas-M small molecule compound
methyl 2-[(3,4-dihydroisoquinolin-2(1H)-ylcarbonothioyl)amino]-5-ethylthiophene-3-carboxylate
Catalog ID
STK435744
SMILES COC(=O)c1cc(sc1NC(=S)N1CCc2c(C1)cccc2)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 C18H20N2O2S2 MW 360.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O2S2/c1-3-14-10-15(17(21)22-2)16(24-14)19-18(23)20-9-8-12-6-4-5-7-13(12)11-20/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,23)InChIKey
WDAPUWCYAKZWJP-UHFFFAOYSA-NSynonyms
CCC1=CC(=C(S1)NC(=S)N2CCC3=CC=CC=C3C2)C(=O)OC
InChI=1SC18H20N2O2S2c13141015(17(21)222)16(2414)1918(23)209812645713(12)1120h4710H38911H212H3(H1923)
methyl2((34dihydroisoquinolin2(1H)ylcarbonothioyl)amino)5ethylthiophene3carboxylate
METHYL2((34DIHYDROISOQUINOLIN2(1H)YLCARBOTHIOYL)AMINO)5ETHYLTHIOPHENE3CARBOXYLATE
METHYL2(34DIHYDRO1HISOQUINOLINE2CARBOTHIOYLAMINO)5ETHYLTHIOPHENE3CARBOXYLATE
MFCD03944235
ZINC000002853183
ZINC02853183
ZINC2853183
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