Vitas-M small molecule compound

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

Catalog ID
STL341304
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1Cc1ccco1)c1ccco1

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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 C21H18N4O5S MW 438.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O5S/c26-19(22-14-5-6-16-18(11-14)30-10-9-29-16)13-31-21-24-23-20(17-4-2-8-28-17)25(21)12-15-3-1-7-27-15/h1-8,11H,9-10,12-13H2,(H,22,26)
InChIKey
LCEYONVRHWRLNF-UHFFFAOYSA-N
Synonyms
575471-33-9
575471339
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NN=C(N3CC4=CC=CO4)C5=CC=CO5
InChI=1SC21H18N4O5Sc2619(2214561618(1114)301092916)133121242320(174282817)25(21)12153172715h1811H9101213H2(H2226)
MFCD04026427
N(23DIHYDRO14BENZODIOXIN6YL)2((5(FURAN2YL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(23dihydro14benzodioxin6yl)2((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N(23dihydrobenzo(b)(14)dioxin6yl)2((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)thio)acetamide
N(2H3HBENZO(34E)14DIOXIN6YL)2(5(2FURYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002376225
ZINC02376225
ZINC2376225

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Available files

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