Vitas-M small molecule compound
N-(3,4-difluorophenyl)-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389850
SMILES O=C(C1CCN(c2c(O1)cccc2)S(=O)(=O)C)Nc1ccc(c(c1)F)F
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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 C17H16F2N2O4S MW 382.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F2N2O4S/c1-26(23,24)21-9-8-16(25-15-5-3-2-4-14(15)21)17(22)20-11-6-7-12(18)13(19)10-11/h2-7,10,16H,8-9H2,1H3,(H,20,22)InChIKey
JSCXCAWGVHEGFK-UHFFFAOYSA-NSynonyms
CS(=O)(=O)N1CCC(OC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)F)F
InChI=1SC17H16F2N2O4Sc126(2324)219816(2515532414(15)21)17(22)20116712(18)13(19)1011h271016H89H21H3(H2022)
MFCD13988636
N(34difluorophenyl)5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
N(34difluorophenyl)5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
ZINC000030938470
ZINC000030938473
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