Vitas-M small molecule compound
ethyl 4-({2-[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanoyl}amino)benzoate
Catalog ID
STK211743
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C(Sc1nnc([nH]1)CC)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 C16H20N4O3S MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O3S/c1-4-13-18-16(20-19-13)24-10(3)14(21)17-12-8-6-11(7-9-12)15(22)23-5-2/h6-10H,4-5H2,1-3H3,(H,17,21)(H,18,19,20)InChIKey
OOVLJKCSGRKGFW-UHFFFAOYSA-NSynonyms
708293-89-4708293894
CCC1=NC(=NN1)SC(C)C(=O)NC2=CC=C(C=C2)C(=O)OCC
CCOC(=O)c1ccc(cc1)NC(=O)C(Sc1nnc((nH)1)CC)C
ETHYL4(((2R)2((5ETHYL1H124TRIAZOL3YL)SULFANYL)PROPANOYL)AMINO)BENZOATE
ETHYL4((2((5ETHYL4H124TRIAZOL3YL)SULFANYL)PROPANOYL)AMINO)BENZOATE
ETHYL4(2((5ETHYL1H124TRIAZOL3YL)SULFANYL)PROPANOYLAMINO)BENZOATE
InChI=1SC16H20N4O3Sc14131816(201913)2410(3)14(21)17128611(7912)15(22)2352h610H45H213H3(H1721)(H181920)
MFCD05993099
ZINC000006574011
ZINC000006574013
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