Vitas-M small molecule compound
3,4-dichloro-N-{2-[5-({2-[(2,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK186709
SMILES CCn1c(CCNC(=O)c2ccc(c(c2)Cl)Cl)nnc1SCC(=O)Nc1cc(Cl)ccc1Cl
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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 C21H19Cl4N5O2S MW 547.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl4N5O2S/c1-2-30-18(7-8-26-20(32)12-3-5-14(23)16(25)9-12)28-29-21(30)33-11-19(31)27-17-10-13(22)4-6-15(17)24/h3-6,9-10H,2,7-8,11H2,1H3,(H,26,32)(H,27,31)InChIKey
JOQBGDFPNUIVDC-UHFFFAOYSA-NSynonyms
34DICHLORON(2(5((2((25DICHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(2(5(2(25DICHLOROANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)Cl)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H19Cl4N5O2Sc123018(782620(32)123514(23)16(25)912)282921(30)331119(31)27171013(22)4615(17)24h36910H27811H21H3(H2632)(H2731)
MFCD05998913
ZINC000002867042
ZINC2867042
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