Vitas-M small molecule compound
N-[(4-ethyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK115050
SMILES CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1S
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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 C13H14N4O3S MW 306.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O3S/c1-2-17-11(15-16-13(17)21)6-14-12(18)8-3-4-9-10(5-8)20-7-19-9/h3-5H,2,6-7H2,1H3,(H,14,18)(H,16,21)InChIKey
IORRMUWIUCPEEK-UHFFFAOYSA-NSynonyms
CCN1C(=NNC1=S)CNC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC13H14N4O3Sc121711(151613(17)21)61412(18)834910(58)207199h35H267H21H3(H1418)(H1621)
MFCD04128009
N((4ETHYL5SULFANYL4H124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
N((4ETHYL5SULFANYLIDENE1H124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
ZINC000004690512
ZINC04690512
ZINC4690512
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