Vitas-M small molecule compound

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

Catalog ID
STK848054
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1Cc1ccco1)COc1ccccc1

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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 C23H20N4O5S MW 464.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O5S/c28-22(24-16-8-9-19-20(11-16)32-15-31-19)14-33-23-26-25-21(13-30-17-5-2-1-3-6-17)27(23)12-18-7-4-10-29-18/h1-11H,12-15H2,(H,24,28)
InChIKey
NHUXORCABFRVJO-UHFFFAOYSA-N
Synonyms
710984-10-4
710984104
C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(N3CC4=CC=CO4)COC5=CC=CC=C5
InChI=1SC23H20N4O5Sc2822(2416891920(1116)32153119)143323262521(1330175213617)27(23)121874102918h111H1215H2(H2428)
MFCD05996997
N(13BENZODIOXOL5YL)2((4(FURAN2YLMETHYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((4(furan2ylmethyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)acetamide
N(2H13BENZODIOXOL5YL)2((4(FURAN2YLMETHYL)5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(4(2FURYLMETHYL)5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(benzo(d)(13)dioxol5yl)2((4(furan2ylmethyl)5(phenoxymethyl)4H124triazol3yl)thio)acetamide
ZINC000001077002
ZINC01077002
ZINC1077002

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Available files

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