Vitas-M small molecule compound
4-[(2-{(E)-[(3-phenyl-5-sulfanyl-4H-1,2,4-triazol-4-yl)imino]methyl}phenoxy)methyl]benzoic acid
Catalog ID
STK071044
SMILES OC(=O)c1ccc(cc1)COc1ccccc1/C=N/n1c(S)nnc1c1ccccc1
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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 C23H18N4O3S MW 430.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O3S/c28-22(29)18-12-10-16(11-13-18)15-30-20-9-5-4-8-19(20)14-24-27-21(25-26-23(27)31)17-6-2-1-3-7-17/h1-14H,15H2,(H,26,31)(H,28,29)/b24-14+InChIKey
VELQYAZEYZCWEI-ZVHZXABRSA-NSynonyms
4((2((E)((3PHENYL5SULFANYL4H124TRIAZOL4YL)IMINO)METHYL)PHENOXY)METHYL)BENZOICACID
4((2((E)(3phenyl5sulfanylidene1H124triazol4yl)iminomethyl)phenoxy)methyl)benzoicacid
C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=CC=C3OCC4=CC=C(C=C4)C(=O)O
InChI=1SC23H18N4O3Sc2822(29)18121016(111318)153020954819(20)14242721(252623(27)31)176213717h114H15H2(H2631)(H2829)b2414+
MFCD04086821
OC(=O)c1ccc(cc1)COc1ccccc1C=Nn1c(S)nnc1c1ccccc1
STK071044
ZINC000009296150
ZINC96488871
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