Vitas-M small molecule compound
{2-[(E)-{[3-(pyridin-4-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenoxy}acetic acid
Catalog ID
STL046882
SMILES OC(=O)COc1ccccc1/C=N/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 C16H13N5O3S MW 355.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N5O3S/c22-14(23)10-24-13-4-2-1-3-12(13)9-18-21-15(19-20-16(21)25)11-5-7-17-8-6-11/h1-9H,10H2,(H,20,25)(H,22,23)/b18-9+InChIKey
JVXVXFKGPWYHQT-GIJQJNRQSA-NSynonyms
499126-13-5(2((E)((3(pyridin4yl)5thioxo15dihydro4H124triazol4yl)imino)methyl)phenoxy)aceticacid
2(2((1E)2(5(4PYRIDYL)3SULFANYL(124TRIAZOL4YL))2AZAVINYL)PHENOXY)ACETICACID
2(2((E)(3PYRIDIN4YL5SULFANYLIDENE1H124TRIAZOL4YL)IMINOMETHYL)PHENOXY)ACETICACID
499126135
C1=CC=C(C(=C1)C=NN2C(=NNC2=S)C3=CC=NC=C3)OCC(=O)O
InChI=1SC16H13N5O3Sc2214(23)102413421312(13)9182115(192016(21)25)1157178611h19H10H2(H2025)(H2223)b189+
MFCD03815512
OC(=O)COc1ccccc1C=Nn1c(=S)(nH)nc1c1ccncc1
ZINC000001257750
ZINC1137796
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