Vitas-M small molecule compound
methyl 6-({[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonothioyl}amino)-3-chloro-1-benzothiophene-2-carboxylate
Catalog ID
STK457630
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C23H22ClN3O4S2 MW 504.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O4S2/c1-29-22(28)21-20(24)16-4-3-15(11-19(16)33-21)25-23(32)27-8-6-26(7-9-27)12-14-2-5-17-18(10-14)31-13-30-17/h2-5,10-11H,6-9,12-13H2,1H3,(H,25,32)InChIKey
HRXBOPZMPYRTOG-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)Cl
InChI=1SC23H22ClN3O4S2c12922(28)2120(24)164315(1119(16)3321)2523(32)278626(7927)1214251718(1014)31133017h251011H691213H21H3(H2532)
methyl6(((4(13benzodioxol5ylmethyl)piperazin1yl)carbonothioyl)amino)3chloro1benzothiophene2carboxylate
METHYL6(((4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)CARBOTHIOYL)AMINO)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
METHYL6(((4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)3CHLOROBENZO(B)THIOPHENE2CARBOXYLATE
METHYL6((4(13BENZODIOXOL5YLMETHYL)PIPERAZINE1CARBOTHIOYL)AMINO)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
MFCD04137329
ZINC000020220586
ZINC20220586
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Check stock on Vitas-MAvailable files
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