Vitas-M small molecule compound
7-chloro-N-cyclooctyl-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389886
SMILES O=C(C1CCN(c2c(O1)ccc(c2)Cl)S(=O)(=O)C)NC1CCCCCCC1
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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 C19H27ClN2O4S MW 414.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27ClN2O4S/c1-27(24,25)22-12-11-18(26-17-10-9-14(20)13-16(17)22)19(23)21-15-7-5-3-2-4-6-8-15/h9-10,13,15,18H,2-8,11-12H2,1H3,(H,21,23)InChIKey
QSNXHMGTAXUINI-UHFFFAOYSA-NSynonyms
7chloroNcyclooctyl5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
7chloroNcyclooctyl5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NC3CCCCCCC3
InChI=1SC19H27ClN2O4Sc127(2425)22121118(261710914(20)1316(17)22)19(23)2115753246815h910131518H281112H21H3(H2123)
MFCD13989919
ZINC000030944138
ZINC000030944140
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