Vitas-M small molecule compound
ethyl 5-{[4-(ethoxycarbonyl)-1-(4-ethoxyphenyl)-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxylate
Catalog ID
STL438360
SMILES CCOc1ccc(cc1)n1nnc(c1Sc1snnc1C(=O)OCC)C(=O)OCC
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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 C18H19N5O5S2 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O5S2/c1-4-26-12-9-7-11(8-10-12)23-15(13(19-21-23)16(24)27-5-2)29-18-14(20-22-30-18)17(25)28-6-3/h7-10H,4-6H2,1-3H3InChIKey
OMPOQJPANSGZOJ-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)OCC)SC3=C(N=NS3)C(=O)OCC
ethyl5((4(ethoxycarbonyl)1(4ethoxyphenyl)1H123triazol5yl)sulfanyl)123thiadiazole4carboxylate
ETHYL5((4(ETHOXYCARBONYL)1(4ETHOXYPHENYL)1H123TRIAZOL5YL)THIO)123THIADIAZOLE4CARBOXYLATE
ETHYL5(5ETHOXYCARBONYL3(4ETHOXYPHENYL)TRIAZOL4YL)SULFANYLTHIADIAZOLE4CARBOXYLATE
InChI=1SC18H19N5O5S2c1426129711(81012)2315(13(192123)16(24)2752)291814(20223018)17(25)2863h710H46H213H3
MFCD06242570
ZINC000008694860
ZINC08694860
ZINC8694860
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