Vitas-M small molecule compound
3,4-dichloro-N-{[5-({2-oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STK186608
SMILES C=CCn1c(SCC(=O)Nc2c(Cl)cc(cc2Cl)Cl)nnc1CNC(=O)c1ccc(c(c1)Cl)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 C21H16Cl5N5O2S MW 579.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl5N5O2S/c1-2-5-31-17(9-27-20(33)11-3-4-13(23)14(24)6-11)29-30-21(31)34-10-18(32)28-19-15(25)7-12(22)8-16(19)26/h2-4,6-8H,1,5,9-10H2,(H,27,33)(H,28,32)InChIKey
UZDWOIZLGFZYET-UHFFFAOYSA-NSynonyms
34DICHLORON((5((2OXO2((246TRICHLOROPHENYL)AMINO)ETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
34DICHLORON((5(2OXO2(246TRICHLOROANILINO)ETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)BENZAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2Cl)Cl)Cl)CNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H16Cl5N5O2Sc1253117(92720(33)113413(23)14(24)611)293021(31)341018(32)281915(25)712(22)816(19)26h2468H15910H2(H2733)(H2832)
MFCD04403534
ZINC000002859391
ZINC2859391
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