Vitas-M small molecule compound

butyl 4-{[(4,4-dimethyl-3,8-dioxo-1-sulfanyl-3,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazin-6-yl)carbonyl]amino}benzoate

Catalog ID
STK250680
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N2N1C(C)(C)C(=O)N=C2S

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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 C20H24N4O5S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O5S/c1-4-5-10-29-17(27)12-6-8-13(9-7-12)21-16(26)14-11-15(25)23-19(30)22-18(28)20(2,3)24(14)23/h6-9,14H,4-5,10-11H2,1-3H3,(H,21,26)(H,22,28,30)
InChIKey
OBSGXJGUMDYLEY-UHFFFAOYSA-N
Synonyms
957016-36-3
957016363
butyl4(((44dimethyl38dioxo1sulfanyl3478tetrahydro6Hpyrazolo(12a)(124)triazin6yl)carbonyl)amino)benzoate
butyl4(1mercapto44dimethyl38dioxo4678tetrahydro3Hpyrazolo(12a)(124)triazine6carboxamido)benzoate
MFCD08075748
ZINC000009409739
ZINC000009409740

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Available files

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