Vitas-M small molecule compound

1-(3,4-dihydroxyphenyl)-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STL040922
SMILES C=CCn1c(SCC(=O)c2ccc(c(c2)O)O)nnc1c1cccc(c1)OC

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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 C20H19N3O4S MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S/c1-3-9-23-19(14-5-4-6-15(10-14)27-2)21-22-20(23)28-12-18(26)13-7-8-16(24)17(25)11-13/h3-8,10-11,24-25H,1,9,12H2,2H3
InChIKey
SLHDNIDGJASXKC-UHFFFAOYSA-N
Synonyms
714283-17-7
1(34BIS(OXIDANYL)PHENYL)2((5(3METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIHYDROXYPHENYL)2((5(3METHOXYPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(34dihydroxyphenyl)2((5(3methoxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)ethanone
1(34DIHYDROXYPHENYL)2((5(3METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIHYDROXYPHENYL)2((5(3METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)THIO)ETHANONE
1(34DIHYDROXYPHENYL)2(5(3METHOXYPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ETHAN1ONE
2((4ALLYL5(3METHOXYPHENYL)124TRIAZOL3YL)THIO)1(34DIHYDROXYPHENYL)ETHANONE
2((4allyl5(3methoxyphenyl)4H124triazol3yl)thio)1(34dihydroxyphenyl)ethanone
714283177
COC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)C3=CC(=C(C=C3)O)O
InChI=1SC20H19N3O4Sc1392319(1454615(1014)272)212220(23)281218(26)137816(24)17(25)1113h3810112425H1912H22H3
MFCD05678821
ZINC000001287873
ZINC01287873
ZINC1287873

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Available files

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