Vitas-M small molecule compound
4-(4-ethylphenyl)-4H-1,4-benzothiazine-2-carbonitrile 1,1-dioxide
Catalog ID
STL133497
SMILES N#CC1=CN(c2ccc(cc2)CC)c2c(S1(=O)=O)cccc2
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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 C17H14N2O2S MW 310.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O2S/c1-2-13-7-9-14(10-8-13)19-12-15(11-18)22(20,21)17-6-4-3-5-16(17)19/h3-10,12H,2H2,1H3InChIKey
CYMLCRTWVOODNE-UHFFFAOYSA-NSynonyms
4(4ethylphenyl)11dioxo1$l^(6)4benzothiazine2carbonitrile
4(4ethylphenyl)4H14benzothiazine2carbonitrile11dioxide
CCC1=CC=C(C=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C#N
InChI=1SC17H14N2O2Sc12137914(10813)191215(1118)22(2021)17643516(17)19h31012H2H21H3
MFCD20753711
ZINC000065095883
ZINC65095883
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