Vitas-M small molecule compound
N-(4-ethylphenyl)-7-methyl-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL386172
SMILES CCc1ccc(cc1)NC(=O)C1CCN(c2c(O1)ccc(c2)C)S(=O)(=O)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 C20H24N2O4S MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O4S/c1-4-15-6-8-16(9-7-15)21-20(23)19-11-12-22(27(3,24)25)17-13-14(2)5-10-18(17)26-19/h5-10,13,19H,4,11-12H2,1-3H3,(H,21,23)InChIKey
USYVYJXFZXHXNY-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)C2CCN(C3=C(O2)C=CC(=C3)C)S(=O)(=O)C
InChI=1SC20H24N2O4Sc14156816(9715)2120(23)19111222(27(324)25)171314(2)51018(17)2619h5101319H41112H213H3(H2123)
MFCD27225285
N(4ethylphenyl)7methyl5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
N(4ethylphenyl)7methyl5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
ZINC000064988531
ZINC000064988533
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