Vitas-M small molecule compound
ethyl 4-[({[5-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK213673
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc([nH]1)CC(C)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 C17H22N4O3S MW 362.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O3S/c1-4-24-16(23)12-5-7-13(8-6-12)18-15(22)10-25-17-19-14(20-21-17)9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,18,22)(H,19,20,21)InChIKey
JNJZJDZHTXVMDY-UHFFFAOYSA-NSynonyms
694465-53-7694465537
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)CC(C)C
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc((nH)1)CC(C)C
ETHYL4((((5(2METHYLPROPYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((5(2METHYLPROPYL)1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC17H22N4O3Sc142416(23)125713(8612)1815(22)1025171914(202117)911(2)3h5811H4910H213H3(H1822)(H192021)
MFCD03613154
ZINC000018218125
ZINC18218125
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