Vitas-M small molecule compound
2-({4-ethyl-5-[1-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Catalog ID
STL365461
SMILES CCn1c(SCC(=O)Nc2cccc(c2)C)nnc1C(N1C(=O)COc2c1cccc2)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/c1-4-27-22(16(3)28-18-10-5-6-11-19(18)31-13-21(28)30)25-26-23(27)32-14-20(29)24-17-9-7-8-15(2)12-17/h5-12,16H,4,13-14H2,1-3H3,(H,24,29)InChIKey
JVVSWEUEVQURMW-UHFFFAOYSA-NSynonyms
2((4ethyl5(1(3oxo14benzoxazin4yl)ethyl)124triazol3yl)sulfanyl)N(3methylphenyl)acetamide
2((4ethyl5(1(3oxo23dihydro4H14benzoxazin4yl)ethyl)4H124triazol3yl)sulfanyl)N(3methylphenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C)C(C)N3C(=O)COC4=CC=CC=C43
InChI=1SC23H25N5O3Sc142722(16(3)281810561119(18)311321(28)30)252623(27)321420(29)241797815(2)1217h51216H41314H213H3(H2429)
MFCD09476254
ZINC000015019130
ZINC000015019131
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