Vitas-M small molecule compound

3-[(3-methoxybenzyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL340057
SMILES COc1cccc(c1)CSc1nnc(n1N)c1cc(OC)c(c(c1)OC)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 C19H22N4O4S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O4S/c1-24-14-7-5-6-12(8-14)11-28-19-22-21-18(23(19)20)13-9-15(25-2)17(27-4)16(10-13)26-3/h5-10H,11,20H2,1-4H3
InChIKey
VUGDNFDOUVQFDQ-UHFFFAOYSA-N
Synonyms
676588-52-6
3((3methoxybenzyl)sulfanyl)5(345trimethoxyphenyl)4H124triazol4amine
3((3METHOXYBENZYL)THIO)5(345TRIMETHOXYPHENYL)4H124TRIAZOL4AMINE
3((3METHOXYPHENYL)METHYLSULFANYL)5(345TRIMETHOXYPHENYL)124TRIAZOL4AMINE
3((3METHOXYPHENYL)METHYLTHIO)5(345TRIMETHOXYPHENYL)124TRIAZOLE4YLAMINE
676588526
COC1=CC=CC(=C1)CSC2=NN=C(N2N)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC19H22N4O4Sc1241475612(814)112819222118(23(19)20)13915(252)17(274)16(1013)263h510H1120H214H3
MFCD04016369
ZINC000000731708
ZINC00731708
ZINC731708

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Available files

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