Vitas-M small molecule compound
methyl 3-chloro-6-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)amino]-1-benzothiophene-2-carboxylate
Catalog ID
STK457927
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)Nc1ccc2c(c1)OCCO2
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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 C19H15ClN2O4S2 MW 434.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O4S2/c1-24-18(23)17-16(20)12-4-2-11(9-15(12)28-17)22-19(27)21-10-3-5-13-14(8-10)26-7-6-25-13/h2-5,8-9H,6-7H2,1H3,(H2,21,22,27)InChIKey
GJQSGPHXQKYZOB-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NC3=CC4=C(C=C3)OCCO4)Cl
InChI=1SC19H15ClN2O4S2c12418(23)1716(20)124211(915(12)2817)2219(27)2110351314(810)26762513h2589H67H21H3(H2212227)
methyl3chloro6((23dihydro14benzodioxin6ylcarbamothioyl)amino)1benzothiophene2carboxylate
METHYL3CHLORO6(23DIHYDRO14BENZODIOXIN6YLCARBAMOTHIOYLAMINO)1BENZOTHIOPHENE2CARBOXYLATE
METHYL6(((2H3HBENZO(34E)14DIOXAN6YLAMINO)THIOXOMETHYL)AMINO)3CHLOROBENZO(B)THIOPHENE2CARBOXYLATE
MFCD05057439
ZINC000002852577
ZINC02852577
ZINC2852577
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