Vitas-M small molecule compound
methyl 5-chloro-3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STK527042
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)Cl
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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 C22H22ClFN4O3 MW 444.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClFN4O3/c1-31-22(30)21-20(17-12-14(23)2-7-18(17)25-21)26-19(29)13-27-8-10-28(11-9-27)16-5-3-15(24)4-6-16/h2-7,12,25H,8-11,13H2,1H3,(H,26,29)InChIKey
MLDPYTZNUDJUHW-UHFFFAOYSA-NSynonyms
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)Cl
COC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC22H22ClFN4O3c13122(30)2120(171214(23)2718(17)2521)2619(29)132781028(11927)165315(24)4616h271225H81113H21H3(H2629)
methyl5chloro3(((4(4fluorophenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL5CHLORO3((2(4(4FLUOROPHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl5chloro3(2(4(4fluorophenyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD02239510
ZINC000057050675
ZINC57050675
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