Vitas-M small molecule compound

N-[2-({2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]butanamide

Catalog ID
STK139350
SMILES CCCC(=O)Nc1ccc2c(c1)sc(n2)SCC(=O)N1CCN(CC1)c1ccc(cc1)Cl

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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 C23H25ClN4O2S2 MW 489.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN4O2S2/c1-2-3-21(29)25-17-6-9-19-20(14-17)32-23(26-19)31-15-22(30)28-12-10-27(11-13-28)18-7-4-16(24)5-8-18/h4-9,14H,2-3,10-13,15H2,1H3,(H,25,29)
InChIKey
OVHHYWWSOHGWGH-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)Cl
InChI=1SC23H25ClN4O2S2c12321(29)2517691920(1417)3223(2619)311522(30)28121027(111328)187416(24)5818h4914H23101315H21H3(H2529)
MFCD04092417
N(2((2(4(4CHLOROPHENYL)1PIPERAZINYL)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)BUTANAMIDE
N(2((2(4(4CHLOROPHENYL)PIPERAZIN1YL)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)BUTANAMIDE
N(2(2(4(4CHLOROPHENYL)PIPERAZIN1YL)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)BUTANAMIDE
ZINC000000624698
ZINC00624698
ZINC624698

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Available files

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