Vitas-M small molecule compound
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1H-1,2,3-triazol-5-ylsulfanyl)acetamide
Catalog ID
STK243238
SMILES O=C(Nc1cc2OCOc2cc1C(=O)C)CSc1cnn[nH]1
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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 C13H12N4O4S MW 320.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O4S/c1-7(18)8-2-10-11(21-6-20-10)3-9(8)15-12(19)5-22-13-4-14-17-16-13/h2-4H,5-6H2,1H3,(H,15,19)(H,14,16,17)InChIKey
VOUPDEKRALIEOH-UHFFFAOYSA-NSynonyms
879026-68-32(1H123TRIAZOL5YLTHIO)N(6ACETYL(2HBENZO(D)13DIOXOLAN5YL))ACETAMIDE
879026683
CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NNN=C3)OCO2
InChI=1SC13H12N4O4Sc17(18)821011(2162010)39(8)1512(19)52213414171613h24H56H21H3(H1519)(H141617)
MFCD02871969
N(6acetyl13benzodioxol5yl)2(1H123triazol5ylsulfanyl)acetamide
N(6ACETYL13BENZODIOXOL5YL)2(2HTRIAZOL4YLSULFANYL)ACETAMIDE
N(6ACETYLBENZO(13)DIOXOL5YL)2(3H(123)TRIAZOL4YLSULFANYL)ACETAMIDE
O=C(Nc1cc2OCOc2cc1C(=O)C)CSc1cnn(nH)1
ZINC000004945289
ZINC04945289
ZINC4945289
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