Vitas-M small molecule compound

4-methoxy-N-[(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]benzamide

Catalog ID
STK186918
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)c1ccc(cc1)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 C21H22N4O4S MW 426.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S/c1-25-19(12-22-20(27)15-6-10-17(29-3)11-7-15)23-24-21(25)30-13-18(26)14-4-8-16(28-2)9-5-14/h4-11H,12-13H2,1-3H3,(H,22,27)
InChIKey
DFTJINLNRODHJU-UHFFFAOYSA-N
Synonyms

4METHOXYN((5((2(4METHOXYPHENYL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((5((2(4METHOXYPHENYL)2OXOETHYL)THIO)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
4METHOXYN((5(2(4METHOXYPHENYL)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC21H22N4O4Sc12519(122220(27)1561017(293)11715)232421(25)301318(26)144816(282)9514h411H1213H213H3(H2227)
MFCD06005664
ZINC000002875278
ZINC02875278
ZINC2875278

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Available files

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