Vitas-M small molecule compound
ethyl 5-{[1-(2-amino-4-methylphenyl)-4-(ethoxycarbonyl)-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxylate
Catalog ID
STL446220
SMILES CCOC(=O)c1nnn(c1Sc1snnc1C(=O)OCC)c1ccc(cc1N)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 C17H18N6O4S2 MW 434.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N6O4S2/c1-4-26-15(24)12-14(28-17-13(20-22-29-17)16(25)27-5-2)23(21-19-12)11-7-6-9(3)8-10(11)18/h6-8H,4-5,18H2,1-3H3InChIKey
QMMNGBLYKCOYBR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)C2=C(C=C(C=C2)C)N)SC3=C(N=NS3)C(=O)OCC
ethyl5((1(2amino4methylphenyl)4(ethoxycarbonyl)1H123triazol5yl)sulfanyl)123thiadiazole4carboxylate
ETHYL5((1(2AMINO4METHYLPHENYL)4(ETHOXYCARBONYL)1H123TRIAZOL5YL)THIO)123THIADIAZOLE4CARBOXYLATE
ETHYL5(3(2AMINO4METHYLPHENYL)5ETHOXYCARBONYLTRIAZOL4YL)SULFANYLTHIADIAZOLE4CARBOXYLATE
InChI=1SC17H18N6O4S2c142615(24)1214(281713(20222917)16(25)2752)23(211912)11769(3)810(11)18h68H4518H213H3
MFCD06242542
ZINC000008694501
ZINC8694501
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