Vitas-M small molecule compound

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

Catalog ID
STL346002
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)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 C22H29ClN4O3 MW 432.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29ClN4O3/c1-30-22(29)21-20(19-16(23)8-5-9-17(19)24-21)25-18(28)14-26-10-12-27(13-11-26)15-6-3-2-4-7-15/h5,8-9,15,24H,2-4,6-7,10-14H2,1H3,(H,25,28)
InChIKey
NDTAIRXDIXEDBK-UHFFFAOYSA-N
Synonyms
848733-39-1
848733391
COC(=O)C1=C(C2=C(N1)C=CC=C2Cl)NC(=O)CN3CCN(CC3)C4CCCCC4
InChI=1SC22H29ClN4O3c13022(29)2120(1916(23)85917(19)2421)2518(28)1426101227(131126)156324715h5891524H24671014H21H3(H2528)
methyl4chloro3(((4cyclohexylpiperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL4CHLORO3((2(4CYCLOHEXYLPIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl4chloro3(2(4cyclohexylpiperazin1yl)acetamido)1Hindole2carboxylate
MFCD04194162
ZINC000020443225
ZINC20443225

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Available files

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