Vitas-M small molecule compound
N-(5-chloro-2-methylphenyl)-2-[(4-ethyl-5-{[4-(propan-2-yl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STK139739
SMILES CCn1c(COc2ccc(cc2)C(C)C)nnc1SCC(=O)Nc1cc(Cl)ccc1C
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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 C23H27ClN4O2S MW 459.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN4O2S/c1-5-28-21(13-30-19-10-7-17(8-11-19)15(2)3)26-27-23(28)31-14-22(29)25-20-12-18(24)9-6-16(20)4/h6-12,15H,5,13-14H2,1-4H3,(H,25,29)InChIKey
NEYXONKDYLRQQV-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)C)COC3=CC=C(C=C3)C(C)C
InChI=1SC23H27ClN4O2Sc152821(13301910717(81119)15(2)3)262723(28)311422(29)25201218(24)9616(20)4h61215H51314H214H3(H2529)
MFCD04090734
N(5CHLORO2METHYLPHENYL)2((4ETHYL5((4(PROPAN2YL)PHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(5CHLORO2METHYLPHENYL)2((4ETHYL5((4ISOPROPYLPHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(5CHLORO2METHYLPHENYL)2((4ETHYL5((4PROPAN2YLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000000686627
ZINC00686627
ZINC686627
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