Vitas-M small molecule compound
4-chloro-N-{1-[4-ethyl-5-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK114679
SMILES CCn1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1C(NC(=O)c1ccc(cc1)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 C23H26ClN5O3S MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN5O3S/c1-5-29-21(15(3)25-22(31)16-7-9-17(24)10-8-16)27-28-23(29)33-13-20(30)26-18-12-14(2)6-11-19(18)32-4/h6-12,15H,5,13H2,1-4H3,(H,25,31)(H,26,30)InChIKey
DFTKBLIXXDYJCN-UHFFFAOYSA-NSynonyms
4CHLORON(1(4ETHYL5((2((2METHOXY5METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4CHLORON(1(4ETHYL5((2(2METHOXY5METHYLANILINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4CHLORON(1(4ETHYL5(2(2METHOXY5METHYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C)OC)C(C)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC23H26ClN5O3Sc152921(15(3)2522(31)167917(24)10816)272823(29)331320(30)26181214(2)61119(18)324h61215H513H214H3(H2531)(H2630)
MFCD04090980
ZINC000000687479
ZINC000000687480
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