Vitas-M small molecule compound
N-(4-bromophenyl)-7-methyl-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL386154
SMILES Brc1ccc(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 C18H19BrN2O4S MW 439.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrN2O4S/c1-12-3-8-16-15(11-12)21(26(2,23)24)10-9-17(25-16)18(22)20-14-6-4-13(19)5-7-14/h3-8,11,17H,9-10H2,1-2H3,(H,20,22)InChIKey
BOQYSGKKLDCRTQ-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OC(CCN2S(=O)(=O)C)C(=O)NC3=CC=C(C=C3)Br
InChI=1SC18H19BrN2O4Sc112381615(1112)21(26(223)24)10917(2516)18(22)20146413(19)5714h381117H910H212H3(H2022)
MFCD27225268
N(4bromophenyl)7methyl5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
N(4bromophenyl)7methyl5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
ZINC000064988481
ZINC000064988482
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