Vitas-M small molecule compound
ethyl 4-({[(5-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK114485
SMILES CCCCc1nnc([nH]1)SCC(=O)Nc1ccc(cc1)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 C17H22N4O3S MW 362.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O3S/c1-3-5-6-14-19-17(21-20-14)25-11-15(22)18-13-9-7-12(8-10-13)16(23)24-4-2/h7-10H,3-6,11H2,1-2H3,(H,18,22)(H,19,20,21)InChIKey
JWLDAFJAYZCQKS-UHFFFAOYSA-NSynonyms
432509-50-7432509507
CCCCC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)OCC
CCCCc1nnc((nH)1)SCC(=O)Nc1ccc(cc1)C(=O)OCC
ETHYL4((((5BUTYL1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((((5BUTYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((5BUTYL1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC17H22N4O3Sc1356141917(212014)251115(22)18139712(81013)16(23)2442h710H3611H212H3(H1822)(H192021)
MFCD02872933
ZINC000018093600
ZINC18093600
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