Vitas-M small molecule compound

2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,5-dimethoxyphenyl)ethanone

Catalog ID
STK012513
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)c1cc(OC)ccc1OC

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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 C25H22ClN3O4S MW 495.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O4S/c1-31-19-10-4-16(5-11-19)24-27-28-25(29(24)18-8-6-17(26)7-9-18)34-15-22(30)21-14-20(32-2)12-13-23(21)33-3/h4-14H,15H2,1-3H3
InChIKey
OYUIVHNIISLDKG-UHFFFAOYSA-N
Synonyms
498547-09-4
1(25DIMETHOXYPHENYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(25DIMETHOXYPHENYL)ETHANONE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(25DIMETHOXYPHENYL)ETHAN1ONE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(25DIMETHOXYPHENYL)ETHANONE
2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)1(25dimethoxyphenyl)ethanone
498547094
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)C4=C(C=CC(=C4)OC)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)c1cc(OC)ccc1OC
InChI=1SC25H22ClN3O4Sc1311910416(51119)24272825(29(24)188617(26)7918)341522(30)211420(322)121323(21)333h414H15H213H3
MFCD03223195
STK012513
ZINC000001132617
ZINC01132617
ZINC1132617

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Available files

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