Vitas-M small molecule compound
({5-[4-(acetylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetic acid
Catalog ID
STK114738
SMILES OC(=O)CSc1nnc(n1C)c1ccc(cc1)NC(=O)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 C13H14N4O3S MW 306.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O3S/c1-8(18)14-10-5-3-9(4-6-10)12-15-16-13(17(12)2)21-7-11(19)20/h3-6H,7H2,1-2H3,(H,14,18)(H,19,20)InChIKey
ORINDTIXILRUBB-UHFFFAOYSA-NSynonyms
((5(4(ACETYLAMINO)PHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
2((5(4ACETAMIDOPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETICACID
CC(=O)NC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)O
InChI=1SC13H14N4O3Sc18(18)1410539(4610)12151613(17(12)2)21711(19)20h36H7H212H3(H1418)(H1920)
MFCD03700350
ZINC000001019438
ZINC1019438
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