Vitas-M small molecule compound
3,4-dichloro-N-[1-(5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK230409
SMILES CCn1c(SCC(=O)NC2CCCC2)nnc1C(NC(=O)c1ccc(c(c1)Cl)Cl)C
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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 C20H25Cl2N5O2S MW 470.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25Cl2N5O2S/c1-3-27-18(12(2)23-19(29)13-8-9-15(21)16(22)10-13)25-26-20(27)30-11-17(28)24-14-6-4-5-7-14/h8-10,12,14H,3-7,11H2,1-2H3,(H,23,29)(H,24,28)InChIKey
RKDLBILBRGZEQH-UHFFFAOYSA-NSynonyms
34DICHLORON(1(5((2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(1(5(2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2CCCC2)C(C)NC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC20H25Cl2N5O2Sc132718(12(2)2319(29)138915(21)16(22)1013)252620(27)301117(28)2414645714h8101214H3711H212H3(H2329)(H2428)
MFCD07790458
ZINC000009263734
ZINC000009263735
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