Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL407107
SMILES O=C(NCc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccccc1)c1cccs1
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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 C22H18N4O3S2 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3S2/c27-20(23-12-15-8-9-17-18(11-15)29-14-28-17)13-31-22-25-24-21(19-7-4-10-30-19)26(22)16-5-2-1-3-6-16/h1-11H,12-14H2,(H,23,27)InChIKey
JGSYJNTXCFGEIK-UHFFFAOYSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CS5
InChI=1SC22H18N4O3S2c2720(231215891718(1115)29142817)133122252421(1974103019)26(22)165213616h111H1214H2(H2327)
MFCD05130086
N(13BENZODIOXOL5YLMETHYL)2((4PHENYL5(2THIENYL)4H124TRIAZOL3YL)THIO)ACETAMIDE
N(13benzodioxol5ylmethyl)2((4phenyl5(thiophen2yl)4H124triazol3yl)sulfanyl)acetamide
N(13BENZODIOXOL5YLMETHYL)2((4PHENYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002849008
ZINC02849008
ZINC2849008
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