Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL298760
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1Cc1ccco1)c1ccccc1
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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 C22H18N4O4S MW 434.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O4S/c27-20(23-16-8-9-18-19(11-16)30-14-29-18)13-31-22-25-24-21(15-5-2-1-3-6-15)26(22)12-17-7-4-10-28-17/h1-11H,12-14H2,(H,23,27)InChIKey
YPPPGXUNGUSXIJ-UHFFFAOYSA-NSynonyms
849029-37-4849029374
C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(N3CC4=CC=CO4)C5=CC=CC=C5
InChI=1SC22H18N4O4Sc2720(2316891819(1116)30142918)133122252421(155213615)26(22)121774102817h111H1214H2(H2327)
MFCD05514026
N(13BENZODIOXOL5YL)2((4(FURAN2YLMETHYL)5PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((4(furan2ylmethyl)5phenyl4H124triazol3yl)sulfanyl)acetamide
N(2H13BENZODIOXOL5YL)2((4(FURAN2YLMETHYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(4(2FURYLMETHYL)5PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
N(benzo(d)(13)dioxol5yl)2((4(furan2ylmethyl)5phenyl4H124triazol3yl)thio)acetamide
ZINC000002454004
ZINC02454004
ZINC2454004
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