Vitas-M small molecule compound
N-{[4-ethyl-5-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-1,3-benzodioxole-5-carboxamide
Catalog ID
STK297783
SMILES CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCC(=O)Nc1nnc(s1)C
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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 C18H19N7O4S2 MW 461.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N7O4S2/c1-3-25-14(7-19-16(27)11-4-5-12-13(6-11)29-9-28-12)22-24-18(25)30-8-15(26)20-17-23-21-10(2)31-17/h4-6H,3,7-9H2,1-2H3,(H,19,27)(H,20,23,26)InChIKey
MQTYIFXURCRMLH-UHFFFAOYSA-NSynonyms
BENZO(13)DIOXOLE5CARBOXYLICACID(4ETHYL5((5METHYL(134)THIADIAZOL2YLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YLMETHYL)AMIDE
CCN1C(=NN=C1SCC(=O)NC2=NN=C(S2)C)CNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC18H19N7O4S2c132514(71916(27)11451213(611)2992812)222418(25)30815(26)2017232110(2)3117h46H379H212H3(H1927)(H202326)
MFCD09961177
N((4ethyl5((2((5methyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)13benzodioxole5carboxamide
N((4ethyl5(2((5methyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl124triazol3yl)methyl)13benzodioxole5carboxamide
ZINC000013956735
ZINC13956735
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