Vitas-M small molecule compound
4-(4-methoxyphenyl)-3-(3-methylphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK577123
SMILES COc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1cccc(c1)C
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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 C25H23N3OS MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3OS/c1-19-8-6-12-21(18-19)24-26-27-25(28(24)22-13-15-23(29-2)16-14-22)30-17-7-11-20-9-4-3-5-10-20/h3-16,18H,17H2,1-2H3/b11-7+InChIKey
UGAVSNHMOOJHCV-YRNVUSSQSA-NSynonyms
862184-47-21(3((2E)3PHENYLPROP2ENYLTHIO)5(3METHYLPHENYL)(124TRIAZOL4YL))4METHOXYBENZENE
3(cinnamylthio)4(4methoxyphenyl)5(mtolyl)4H124triazole
4(4methoxyphenyl)3(3methylphenyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
4(4METHOXYPHENYL)3(3METHYLPHENYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
862184472
CC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC=CC4=CC=CC=C4
COc1ccc(cc1)n1c(SCC=Cc2ccccc2)nnc1c1cccc(c1)C
InChI=1SC25H23N3OSc119861221(1819)24262725(28(24)22131523(292)161422)30177112094351020h31618H17H212H3b117+
MFCD05687800
ZINC000005485606
ZINC05485606
ZINC5485606
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