Vitas-M small molecule compound
3-(3-methyl-1-phenyl-5-thioxo-1,2,4-triazolidin-3-yl)propanoic acid
Catalog ID
STK696573
SMILES OC(=O)CCC1(C)NN(C(=S)N1)c1ccccc1
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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 C12H15N3O2S MW 265.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O2S/c1-12(8-7-10(16)17)13-11(18)15(14-12)9-5-3-2-4-6-9/h2-6,14H,7-8H2,1H3,(H,13,18)(H,16,17)InChIKey
DRFMFHJHXWISLA-UHFFFAOYSA-NSynonyms
3(3METHYL1PHENYL5SULFANYLIDENE124TRIAZOLIDIN3YL)PROPANOICACID
3(3methyl1phenyl5thioxo124triazolidin3yl)propanoicacid
CC1(NC(=S)N(N1)C2=CC=CC=C2)CCC(=O)O
InChI=1SC12H15N3O2Sc112(8710(16)17)1311(18)15(1412)9532469h2614H78H21H3(H1318)(H1617)
MFCD03196709
ZINC000000033639
ZINC000000033640
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