Vitas-M small molecule compound

methyl 3-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-4-methyl-1H-indole-2-carboxylate

Catalog ID
STL347056
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)c(C)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 C24H27ClN4O3 MW 454.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN4O3/c1-15-7-8-17(25)13-19(15)29-11-9-28(10-12-29)14-20(30)27-22-21-16(2)5-4-6-18(21)26-23(22)24(31)32-3/h4-8,13,26H,9-12,14H2,1-3H3,(H,27,30)
InChIKey
BKAMWRTYRYYJHZ-UHFFFAOYSA-N
Synonyms
849009-38-7
849009387
CC1=C2C(=CC=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)c(C)ccc2
InChI=1SC24H27ClN4O3c1157817(25)1319(15)2911928(101229)1420(30)27222116(2)54618(21)2623(22)24(31)323h481326H91214H213H3(H2730)
METHYL3(((4(5CHLORO2METHYLPHENYL)1PIPERAZINYL)ACETYL)AMINO)4METHYL1HINDOLE2CARBOXYLATE
methyl3(((4(5chloro2methylphenyl)piperazin1yl)acetyl)amino)4methyl1Hindole2carboxylate
METHYL3((2(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)ACETYL)AMINO)4METHYL1HINDOLE2CARBOXYLATE
methyl3(2(4(5chloro2methylphenyl)piperazin1yl)acetamido)4methyl1Hindole2carboxylate
MFCD05680492
ZINC000035843273
ZINC35843273

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Available files

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