Vitas-M small molecule compound
{4-[3-(pyridin-4-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}acetic acid
Catalog ID
STK596300
SMILES OC(=O)Cc1ccc(cc1)n1c(=S)[nH]nc1c1ccncc1
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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 C15H12N4O2S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O2S/c20-13(21)9-10-1-3-12(4-2-10)19-14(17-18-15(19)22)11-5-7-16-8-6-11/h1-8H,9H2,(H,18,22)(H,20,21)InChIKey
RFMLYQZRDBZNEZ-UHFFFAOYSA-NSynonyms
727684-84-6(4(3(pyridin4yl)5thioxo15dihydro4H124triazol4yl)phenyl)aceticacid
(4(3MERCAPTO5PYRIDIN4YL(124)TRIAZOL4YL)PHENYL)ACETICACID
2(4(3PYRIDIN4YL5SULFANYLIDENE1H124TRIAZOL4YL)PHENYL)ACETICACID
727684846
C1=CC(=CC=C1CC(=O)O)N2C(=NNC2=S)C3=CC=NC=C3
InChI=1SC15H12N4O2Sc2013(21)9101312(4210)1914(171815(19)22)1157168611h18H9H2(H1822)(H2021)
MFCD07198033
OC(=O)Cc1ccc(cc1)n1c(=S)(nH)nc1c1ccncc1
ZINC000005813707
ZINC5813707
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