Vitas-M small molecule compound
N-{2-[3-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}-2-methylpropanamide
Catalog ID
STL572349
SMILES O=C(Nc1ccc(cc1C)C)CSc1nnc(c(=O)[nH]1)c1ccccc1NC(=O)C(C)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 C23H25N5O3S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O3S/c1-13(2)21(30)25-18-8-6-5-7-16(18)20-22(31)26-23(28-27-20)32-12-19(29)24-17-10-9-14(3)11-15(17)4/h5-11,13H,12H2,1-4H3,(H,24,29)(H,25,30)(H,26,28,31)InChIKey
QCKBVSQNCNCAFJ-UHFFFAOYSA-NSynonyms
135969595
InChI=1SC23H25N5O3Sc113(2)21(30)2518865716(18)2022(31)2623(282720)321219(29)241710914(3)1115(17)4h51113H12H214H3(H2429)(H2530)(H262831)
MFCD27590002
N(2(3((2((24dimethylphenyl)amino)2oxoethyl)sulfanyl)5oxo45dihydro124triazin6yl)phenyl)2methylpropanamide
N(2(3((2((24DIMETHYLPHENYL)AMINO)2OXOETHYL)THIO)5OXO45DIHYDRO124TRIAZIN6YL)PHENYL)2METHYLPROPANAMIDE
N(2(3(2(24dimethylanilino)2oxoethyl)sulfanyl5oxo4H124triazin6yl)phenyl)2methylpropanamide
ZINC000064774578
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