Vitas-M small molecule compound
2-{[5-(3-aminophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone
Catalog ID
STK202339
SMILES CCn1c(SCC(=O)N2CCN(CC2)c2cccc(c2)Cl)nnc1c1cccc(c1)N
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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 C22H25ClN6OS MW 457.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN6OS/c1-2-29-21(16-5-3-7-18(24)13-16)25-26-22(29)31-15-20(30)28-11-9-27(10-12-28)19-8-4-6-17(23)14-19/h3-8,13-14H,2,9-12,15,24H2,1H3InChIKey
TZUPLMUDSUKQQO-UHFFFAOYSA-NSynonyms
2((5(3aminophenyl)4ethyl124triazol3yl)sulfanyl)1(4(3chlorophenyl)piperazin1yl)ethanone
2((5(3AMINOPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)1(4(3CHLOROPHENYL)PIPERAZIN1YL)ETHANONE
CCN1C(=NN=C1SCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)N
InChI=1SC22H25ClN6OSc122921(1653718(24)1316)252622(29)311520(30)2811927(101228)1984617(23)1419h381314H29121524H21H3
MFCD04336068
ZINC000009970927
ZINC09970927
ZINC9970927
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