Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-(2-methylpropyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK261268
SMILES CC(Cn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1c1cccnc1)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 C21H23N5O3S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O3S/c1-14(2)12-26-20(15-4-3-7-22-11-15)24-25-21(26)30-13-19(27)23-16-5-6-17-18(10-16)29-9-8-28-17/h3-7,10-11,14H,8-9,12-13H2,1-2H3,(H,23,27)
InChIKey
MUKCARJMTJJYKL-UHFFFAOYSA-N
Synonyms

CC(C)CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CN=CC=C4
InChI=1SC21H23N5O3Sc114(2)122620(15437221115)242521(26)301319(27)2316561718(1016)29982817h37101114H891213H212H3(H2327)
MFCD08685521
N(23dihydro14benzodioxin6yl)2((4(2methylpropyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)acetamide
N(23dihydro14benzodioxin6yl)2((4(2methylpropyl)5pyridin3yl124triazol3yl)sulfanyl)acetamide
N(23DIHYDROBENZO(14)DIOXIN6YL)2(4ISOBUTYL5PYRIDIN3YL4H(124)TRIAZOL3YLSULFANYL)ACETAMIDE
ZINC000009426922
ZINC09426922
ZINC9426922

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Available files

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