Vitas-M small molecule compound

3-{[(3-phenyl-5-sulfanyl-4H-1,2,4-triazol-4-yl)imino]methyl}phenol

Catalog ID
STK109245
SMILES Oc1cccc(c1)/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 C15H12N4OS MW 296.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4OS/c20-13-8-4-5-11(9-13)10-16-19-14(17-18-15(19)21)12-6-2-1-3-7-12/h1-10,20H,(H,18,21)
InChIKey
YTDCANSRQNUQRX-UHFFFAOYSA-N
Synonyms

(E)3(((3mercapto5phenyl4H124triazol4yl)imino)methyl)phenol
3(((3PHENYL5SULFANYL4H124TRIAZOL4YL)IMINO)METHYL)PHENOL
3((1Z)2(5PHENYL3SULFANYL(124TRIAZOL4YL))2AZAVINYL)PHENOL
4((3HYDROXYPHENYL)METHYLIDENEAMINO)3PHENYL1H124TRIAZOLE5THIONE
C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC(=CC=C3)O
InChI=1SC15H12N4OSc201384511(913)10161914(171815(19)21)126213712h11020H(H1821)
MFCD03218400
Oc1cccc(c1)C=Nn1c(S)nnc1c1ccccc1
ZINC000245254046

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.