Vitas-M small molecule compound
methyl 4-chloro-3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STL055465
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)c(Cl)ccc2
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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(19-16(23)3-2-4-17(19)25-21)26-18(29)13-27-9-11-28(12-10-27)15-7-5-14(24)6-8-15/h2-8,25H,9-13H2,1H3,(H,26,29)InChIKey
YBOJJWUGPSXELA-UHFFFAOYSA-NSynonyms
714225-37-3714225373
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)c(Cl)ccc2
COC(=O)C1=C(C2=C(N1)C=CC=C2Cl)NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC22H22ClFN4O3c13122(30)2120(1916(23)32417(19)2521)2618(29)132791128(121027)157514(24)6815h2825H913H21H3(H2629)
methyl4chloro3(((4(4fluorophenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL4CHLORO3((2(4(4FLUOROPHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl4chloro3(2(4(4fluorophenyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD04160128
ZINC000057462933
ZINC57462933
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