Vitas-M small molecule compound
2-{[5-(1,3-benzodioxol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4,5-dimethyl-1,3-thiazol-2-yl)propanamide
Catalog ID
STK231011
SMILES CC(C(=O)Nc1sc(c(n1)C)C)Sc1nnc(n1C)c1ccc2c(c1)OCO2
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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 C18H19N5O3S2 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O3S2/c1-9-10(2)27-17(19-9)20-16(24)11(3)28-18-22-21-15(23(18)4)12-5-6-13-14(7-12)26-8-25-13/h5-7,11H,8H2,1-4H3,(H,19,20,24)InChIKey
DQILAHCGHRMJBW-UHFFFAOYSA-NSynonyms
2((5(13BENZODIOXOL5YL)4METHYL124TRIAZOL3YL)SULFANYL)N(45DIMETHYL13THIAZOL2YL)PROPANAMIDE
2((5(13benzodioxol5yl)4methyl4H124triazol3yl)sulfanyl)N(45dimethyl13thiazol2yl)propanamide
2(5BENZO(13)DIOXOL5YL4METHYL4H(124)TRIAZOL3YLSULFANYL)N(45DIMETHYLTHIAZOL2YL)PROPIONAMIDE
CC1=C(SC(=N1)NC(=O)C(C)SC2=NN=C(N2C)C3=CC4=C(C=C3)OCO4)C
InChI=1SC18H19N5O3S2c1910(2)2717(199)2016(24)11(3)2818222115(23(18)4)12561314(712)2682513h5711H8H214H3(H192024)
MFCD07791803
ZINC000004736391
ZINC000004736392
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