Vitas-M small molecule compound
N-(3,5-dimethylphenyl)-4,4-dimethyl-3,8-dioxo-1-sulfanyl-3,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazine-6-carboxamide
Catalog ID
STK250684
SMILES O=C(C1CC(=O)N2N1C(C)(C)C(=O)N=C2S)Nc1cc(C)cc(c1)C
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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 C17H20N4O3S MW 360.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O3S/c1-9-5-10(2)7-11(6-9)18-14(23)12-8-13(22)20-16(25)19-15(24)17(3,4)21(12)20/h5-7,12H,8H2,1-4H3,(H,18,23)(H,19,24,25)InChIKey
URLYGDAIPOHWMP-UHFFFAOYSA-NSynonyms
(44DIMETHYL38DIOXO1SULFANYLPYRAZOLIDINO(12A)124TRIAZIN6YL)N(35DIMETHYLPHENYL)CARBOXAMIDE
CC1=CC(=CC(=C1)NC(=O)C2CC(=O)N3N2C(C(=O)NC3=S)(C)C)C
InChI=1SC17H20N4O3Sc19510(2)711(69)1814(23)12813(22)2016(25)1915(24)17(34)21(12)20h5712H8H214H3(H1823)(H192425)
MFCD08075758
N(35dimethylphenyl)44dimethyl38dioxo1sulfanyl3478tetrahydro6Hpyrazolo(12a)(124)triazine6carboxamide
N(35dimethylphenyl)44dimethyl38dioxo1sulfanylidene67dihydropyrazolo(12a)(124)triazine6carboxamide
ZINC000009698280
ZINC000009698281
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