Vitas-M small molecule compound

methyl 4-chloro-3-({[4-(furan-2-ylcarbonyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate

Catalog ID
STL345216
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccco1)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 C21H21ClN4O5 MW 444.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O5/c1-30-21(29)19-18(17-13(22)4-2-5-14(17)23-19)24-16(27)12-25-7-9-26(10-8-25)20(28)15-6-3-11-31-15/h2-6,11,23H,7-10,12H2,1H3,(H,24,27)
InChIKey
BZEPJWXKQNVYGN-UHFFFAOYSA-N
Synonyms
847858-76-8
847858768
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccco1)c(Cl)ccc2
COC(=O)C1=C(C2=C(N1)C=CC=C2Cl)NC(=O)CN3CCN(CC3)C(=O)C4=CC=CO4
InChI=1SC21H21ClN4O5c13021(29)1918(1713(22)42514(17)2319)2416(27)12257926(10825)20(28)1563113115h261123H71012H21H3(H2427)
methyl4chloro3(((4(furan2ylcarbonyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL4CHLORO3((2(4(FURAN2CARBONYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl4chloro3(2(4(furan2carbonyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD04185748
ZINC000035840362
ZINC35840362

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.