Vitas-M small molecule compound
2-(2,6-dimethylphenoxy)-N-{[5-({2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}acetamide
Catalog ID
STK126405
SMILES CCn1c(CNC(=O)COc2c(C)cccc2C)nnc1SCC(=O)Nc1ccc(c(c1)C)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 C25H31N5O3S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O3S/c1-6-30-21(13-26-22(31)14-33-24-17(3)8-7-9-18(24)4)28-29-25(30)34-15-23(32)27-20-11-10-16(2)19(5)12-20/h7-12H,6,13-15H2,1-5H3,(H,26,31)(H,27,32)InChIKey
WGWACBQUHABFNZ-UHFFFAOYSA-NSynonyms
2(26DIMETHYLPHENOXY)N((5((2((34DIMETHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)METHYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)C)C)CNC(=O)COC3=C(C=CC=C3C)C
InChI=1SC25H31N5O3Sc163021(132622(31)14332417(3)87918(24)4)282925(30)341523(32)2720111016(2)19(5)1220h712H61315H215H3(H2631)(H2732)
MFCD04086100
N((5(2(34DIMETHYLANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)METHYL)2(26DIMETHYLPHENOXY)ACETAMIDE
ZINC000009305551
ZINC09305551
ZINC9305551
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