Vitas-M small molecule compound
N-{[4-methyl-5-({2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-1,3-benzodioxole-5-carboxamide
Catalog ID
STK261095
SMILES O=C(Nc1scc(n1)C)CSc1nnc(n1C)CNC(=O)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 C18H18N6O4S2 MW 446.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O4S2/c1-10-7-29-17(20-10)21-15(25)8-30-18-23-22-14(24(18)2)6-19-16(26)11-3-4-12-13(5-11)28-9-27-12/h3-5,7H,6,8-9H2,1-2H3,(H,19,26)(H,20,21,25)InChIKey
ZQURGKSLNPOZCB-UHFFFAOYSA-NSynonyms
BENZO(13)DIOXOLE5CARBOXYLICACID(4METHYL5((4METHYLTHIAZOL2YLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YLMETHYL)AMIDE
CC1=CSC(=N1)NC(=O)CSC2=NN=C(N2C)CNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC18H18N6O4S2c11072917(2010)2115(25)83018232214(24(18)2)61916(26)11341213(511)2892712h357H689H212H3(H1926)(H202125)
MFCD08670464
N((4METHYL5((2((4METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
N((4methyl5(2((4methyl13thiazol2yl)amino)2oxoethyl)sulfanyl124triazol3yl)methyl)13benzodioxole5carboxamide
ZINC000009426787
ZINC09426787
ZINC9426787
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