Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL294042
SMILES CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1ccc(cc1)C(C)(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 C23H26N4O3S MW 438.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3S/c1-5-27-21(15-6-8-16(9-7-15)23(2,3)4)25-26-22(27)31-13-20(28)24-17-10-11-18-19(12-17)30-14-29-18/h6-12H,5,13-14H2,1-4H3,(H,24,28)InChIKey
BNTVSGCQULYGMH-UHFFFAOYSA-NSynonyms
849028-58-6849028586
CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC23H26N4O3Sc152721(156816(9715)23(23)4)252622(27)311320(28)241710111819(1217)30142918h612H51314H214H3(H2428)
MFCD05681656
N(13BENZODIOXOL5YL)2((5(4TERTBUTYLPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((5(4tertbutylphenyl)4ethyl4H124triazol3yl)sulfanyl)acetamide
N(benzo(d)(13)dioxol5yl)2((5(4(tertbutyl)phenyl)4ethyl4H124triazol3yl)thio)acetamide
ZINC000002453844
ZINC02453844
ZINC2453844
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