Vitas-M small molecule compound
2-methyl-4-oxo-3-[2-(phenylsulfanyl)ethyl]-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxamide
Catalog ID
STL568208
SMILES NC(=O)C1C2CC(N(C1=O)CCSc1ccccc1)(C)Oc1c2cccc1
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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 C21H22N2O3S MW 382.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S/c1-21-13-16(15-9-5-6-10-17(15)26-21)18(19(22)24)20(25)23(21)11-12-27-14-7-3-2-4-8-14/h2-10,16,18H,11-13H2,1H3,(H2,22,24)InChIKey
DYMYHCAIWVPOFA-UHFFFAOYSA-NSynonyms
128963270
2methyl4oxo3(2(phenylsulfanyl)ethyl)3456tetrahydro2H26methano13benzoxazocine5carboxamide
2methyl4oxo3(2(phenylthio)ethyl)3456tetrahydro2H26methanobenzo(g)(13)oxazocine5carboxamide
9methyl11oxo10(2phenylsulfanylethyl)8oxa10azatricyclo(731027)trideca246triene12carboxamide
InChI=1SC21H22N2O3Sc1211316(159561017(15)2621)18(19(22)24)20(25)23(21)111227147324814h2101618H1113H21H3(H22224)
MFCD32653331
ZINC000524734697
ZINC000524734698
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