Vitas-M small molecule compound
ethyl 4-({[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL445358
SMILES CCOC(=O)c1ccc(cc1)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 C15H18N4O3S MW 334.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O3S/c1-3-12-17-15(19-18-12)23-9-13(20)16-11-7-5-10(6-8-11)14(21)22-4-2/h5-8H,3-4,9H2,1-2H3,(H,16,20)(H,17,18,19)InChIKey
TXPLKXYUFAXWGJ-UHFFFAOYSA-NSynonyms
CCC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)OCC
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc((nH)1)CC
ethyl4((((5ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((5ETHYL1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC15H18N4O3Sc13121715(191812)23913(20)16117510(6811)14(21)2242h58H349H212H3(H1620)(H171819)
MFCD02872852
ZINC000004385311
ZINC04385311
ZINC4385311
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