Vitas-M small molecule compound
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK759740
SMILES CCOC(=O)c1nnn(c1CSc1nnc2c(n1)n(C)c1c2cccc1)c1nonc1N
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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 C18H16N10O3S MW 452.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N10O3S/c1-3-30-17(29)13-11(28(26-22-13)16-14(19)24-31-25-16)8-32-18-20-15-12(21-23-18)9-6-4-5-7-10(9)27(15)2/h4-7H,3,8H2,1-2H3,(H2,19,24)InChIKey
HTSNMUAVQPWAIO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=NC4=C(C5=CC=CC=C5N4C)N=N3
ETHYL1(4AMINO(125OXADIAZOL3YL))5((5METHYL(124TRIAZINO(56B)INDOL3YLTHIO))METHYL)123TRIAZOLE4CARBOXYLATE
ethyl1(4amino125oxadiazol3yl)5(((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)methyl)1H123triazole4carboxylate
ETHYL1(4AMINO125OXADIAZOL3YL)5((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYLMETHYL)TRIAZOLE4CARBOXYLATE
InChI=1SC18H16N10O3Sc133017(29)1311(28(262213)1614(19)24312516)83218201512(212318)9645710(9)27(15)2h47H38H212H3(H21924)
MFCD01572648
ZINC000002025404
ZINC02025404
ZINC2025404
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