Vitas-M small molecule compound
N-[2-(methylsulfanyl)phenyl]-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Catalog ID
STL389845
SMILES CSc1ccccc1NC(=O)C1CCN(c2c(O1)cccc2)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 C18H20N2O4S2 MW 392.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S2/c1-25-17-10-6-3-7-13(17)19-18(21)16-11-12-20(26(2,22)23)14-8-4-5-9-15(14)24-16/h3-10,16H,11-12H2,1-2H3,(H,19,21)InChIKey
CJYLJCDTGOSAHX-UHFFFAOYSA-NSynonyms
CSC1=CC=CC=C1NC(=O)C2CCN(C3=CC=CC=C3O2)S(=O)(=O)C
InChI=1SC18H20N2O4S2c125171063713(17)1918(21)16111220(26(222)23)14845915(14)2416h31016H1112H212H3(H1921)
MFCD13988561
N(2(methylsulfanyl)phenyl)5(methylsulfonyl)2345tetrahydro15benzoxazepine2carboxamide
N(2methylsulfanylphenyl)5methylsulfonyl34dihydro2H15benzoxazepine2carboxamide
ZINC000030938158
ZINC000030938161
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