Vitas-M small molecule compound
methyl 3-({[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL416256
SMILES COC(=O)c1cccc(c1)NC(=O)CSc1nnc([nH]1)CC
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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 C14H16N4O3S MW 320.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O3S/c1-3-11-16-14(18-17-11)22-8-12(19)15-10-6-4-5-9(7-10)13(20)21-2/h4-7H,3,8H2,1-2H3,(H,15,19)(H,16,17,18)InChIKey
DNHXJXLYBFLOQX-UHFFFAOYSA-NSynonyms
CCC1=NC(=NN1)SCC(=O)NC2=CC=CC(=C2)C(=O)OC
COC(=O)c1cccc(c1)NC(=O)CSc1nnc((nH)1)CC
InChI=1SC14H16N4O3Sc13111614(181711)22812(19)15106459(710)13(20)212h47H38H212H3(H1519)(H161718)
methyl3((((5ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL3((2((5ETHYL1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD05842315
ZINC000006697755
ZINC06697755
ZINC6697755
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