Vitas-M small molecule compound
N-(2-methylphenyl)-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389594
SMILES O=C(C1CCN(c2c(O1)cccc2)S(=O)(=O)C)Nc1ccccc1C
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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 C18H20N2O4S MW 360.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S/c1-13-7-3-4-8-14(13)19-18(21)17-11-12-20(25(2,22)23)15-9-5-6-10-16(15)24-17/h3-10,17H,11-12H2,1-2H3,(H,19,21)InChIKey
JDUMBKVHFWWJPY-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1NC(=O)C2CCN(C3=CC=CC=C3O2)S(=O)(=O)C
InChI=1SC18H20N2O4Sc113734814(13)1918(21)17111220(25(222)23)159561016(15)2417h31017H1112H212H3(H1921)
MFCD13982564
N(2methylphenyl)5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
N(2methylphenyl)5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
ZINC000038833205
ZINC000038833206
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