Vitas-M small molecule compound
2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl 3-methylthiophene-2-carboxylate
Catalog ID
STL014096
SMILES Cc1ccc2c(c1)N(CCO2)C(=O)COC(=O)c1sccc1C
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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 C17H17NO4S MW 331.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4S/c1-11-3-4-14-13(9-11)18(6-7-21-14)15(19)10-22-17(20)16-12(2)5-8-23-16/h3-5,8-9H,6-7,10H2,1-2H3InChIKey
DOMQOOGPOOERQB-UHFFFAOYSA-NSynonyms
(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)3methylthiophene2carboxylate
2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl3methylthiophene2carboxylate
CC1=CC2=C(C=C1)OCCN2C(=O)COC(=O)C3=C(C=CS3)C
InChI=1SC17H17NO4Sc111341413(911)18(672114)15(19)102217(20)1612(2)582316h3589H6710H212H3
MFCD18186321
ZINC000051356824
ZINC51356824
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