Vitas-M small molecule compound
methyl 3-chloro-6-[(3,4-dihydroisoquinolin-2(1H)-ylcarbonothioyl)amino]-1-benzothiophene-2-carboxylate
Catalog ID
STK443474
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)N1CCc2c(C1)cccc2
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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 C20H17ClN2O2S2 MW 416.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O2S2/c1-25-19(24)18-17(21)15-7-6-14(10-16(15)27-18)22-20(26)23-9-8-12-4-2-3-5-13(12)11-23/h2-7,10H,8-9,11H2,1H3,(H,22,26)InChIKey
IINRVHJXTDFRNH-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)N3CCC4=CC=CC=C4C3)Cl
InChI=1SC20H17ClN2O2S2c12519(24)1817(21)157614(1016(15)2718)2220(26)239812423513(12)1123h2710H8911H21H3(H2226)
methyl3chloro6((34dihydroisoquinolin2(1H)ylcarbonothioyl)amino)1benzothiophene2carboxylate
METHYL3CHLORO6((34DIHYDROISOQUINOLIN2(1H)YLCARBOTHIOYL)AMINO)1BENZOTHIOPHENE2CARBOXYLATE
METHYL3CHLORO6(34DIHYDRO1HISOQUINOLINE2CARBOTHIOYLAMINO)1BENZOTHIOPHENE2CARBOXYLATE
MFCD04054756
ZINC000002854631
ZINC02854631
ZINC2854631
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