Vitas-M small molecule compound
N-{2-hydroxy-3-[2-(methylsulfanyl)ethyl]-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-7-yl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL540334
SMILES CSCCC1NC(=O)c2c(N=C1O)ccc(c2)NC(=O)c1ccc2c(c1)OCCCO2
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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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-31-10-7-17-22(28)24-16-5-4-14(12-15(16)21(27)25-17)23-20(26)13-3-6-18-19(11-13)30-9-2-8-29-18/h3-6,11-12,17H,2,7-10H2,1H3,(H,23,26)(H,24,28)(H,25,27)InChIKey
AVHSETZSFQBAMU-UHFFFAOYSA-NSynonyms
~(N)(3(2methylsulfanylethyl)25dioxo34dihydro1~(H)14benzodiazepin7yl)34dihydro2~(H)15benzodioxepine7carboxamide
75531767
MFCD31755059
N(2hydroxy3(2(methylsulfanyl)ethyl)5oxo45dihydro3H14benzodiazepin7yl)34dihydro2H15benzodioxepine7carboxamide
ZINC000096221674
ZINC000206233820
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