Vitas-M small molecule compound
4-(4-chlorophenyl)-3-[(4-methylphenoxy)methyl]-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK593391
SMILES Clc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1COc1ccc(cc1)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 C25H22ClN3OS MW 447.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3OS/c1-19-9-15-23(16-10-19)30-18-24-27-28-25(29(24)22-13-11-21(26)12-14-22)31-17-5-8-20-6-3-2-4-7-20/h2-16H,17-18H2,1H3/b8-5+InChIKey
YGJBCRDDJOTEBX-VMPITWQZSA-NSynonyms
899383-38-11((5((2E)3PHENYLPROP2ENYLTHIO)4(4CHLOROPHENYL)(124TRIAZOL3YL))METHOXY)4METHYLBENZENE
4(4chlorophenyl)3((4methylphenoxy)methyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
4(4CHLOROPHENYL)3((4METHYLPHENOXY)METHYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
4(4CHLOROPHENYL)3(4METHYLPHENOXYMETHYL)5(((2E)3PHENYLPROP2EN1YL)SULFANYL)4H124TRIAZOLE
4(4chlorophenyl)3(cinnamylthio)5((ptolyloxy)methyl)4H124triazole
899383381
CC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC=CC4=CC=CC=C4
Clc1ccc(cc1)n1c(SCC=Cc2ccccc2)nnc1COc1ccc(cc1)C
InChI=1SC25H22ClN3OSc11991523(161019)301824272825(29(24)22131121(26)121422)311758206324720h216H1718H21H3b85+
MFCD06605686
ZINC000002325649
ZINC02325649
ZINC2325649
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