Vitas-M small molecule compound
N-(2,6-dimethylphenyl)-7-methyl-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL386145
SMILES O=C(C1CCN(c2c(O1)ccc(c2)C)S(=O)(=O)C)Nc1c(C)cccc1C
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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 C20H24N2O4S MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O4S/c1-13-8-9-17-16(12-13)22(27(4,24)25)11-10-18(26-17)20(23)21-19-14(2)6-5-7-15(19)3/h5-9,12,18H,10-11H2,1-4H3,(H,21,23)InChIKey
DXSAGFJBMUWGOQ-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OC(CCN2S(=O)(=O)C)C(=O)NC3=C(C=CC=C3C)C
InChI=1SC20H24N2O4Sc113891716(1213)22(27(424)25)111018(2617)20(23)211914(2)65715(19)3h591218H1011H214H3(H2123)
MFCD27225259
N(26dimethylphenyl)7methyl5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
N(26dimethylphenyl)7methyl5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
ZINC000064988453
ZINC000064988455
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