Vitas-M small molecule compound

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

Catalog ID
STL347218
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)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 C22H22Cl2N4O3 MW 461.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N4O3/c1-31-22(30)21-20(19-16(24)3-2-4-17(19)25-21)26-18(29)13-27-9-11-28(12-10-27)15-7-5-14(23)6-8-15/h2-8,25H,9-13H2,1H3,(H,26,29)
InChIKey
LEXYOQZXOPAJAO-UHFFFAOYSA-N
Synonyms
849026-08-0
849026080
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)c(Cl)ccc2
COC(=O)C1=C(C2=C(N1)C=CC=C2Cl)NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)Cl
InChI=1SC22H22Cl2N4O3c13122(30)2120(1916(24)32417(19)2521)2618(29)132791128(121027)157514(23)6815h2825H913H21H3(H2629)
methyl4chloro3(((4(4chlorophenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL4CHLORO3((2(4(4CHLOROPHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl4chloro3(2(4(4chlorophenyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD05681372
ZINC000061943428
ZINC61943428

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Available files

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