Vitas-M small molecule compound
(2E)-3-(azepan-1-yl)-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile
Catalog ID
STK607122
SMILES N#C/C(=C\N1CCCCCC1)/S(=O)(=O)c1ccc(cc1)Cl
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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 C15H17ClN2O2S MW 324.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17ClN2O2S/c16-13-5-7-14(8-6-13)21(19,20)15(11-17)12-18-9-3-1-2-4-10-18/h5-8,12H,1-4,9-10H2/b15-12+InChIKey
GRVPLNRHUHBDBK-NTCAYCPXSA-NSynonyms
904210-71-5(2E)3(azepan1yl)2((4chlorophenyl)sulfonyl)prop2enenitrile
(E)3(azepan1yl)2((4chlorophenyl)sulfonyl)acrylonitrile
(E)3(AZEPAN1YL)2(4CHLOROPHENYL)SULFONYLPROP2ENENITRILE
904210715
C1CCCN(CC1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl
InChI=1SC15H17ClN2O2Sc16135714(8613)21(1920)15(1117)1218931241018h5812H14910H2b1512+
MFCD07643051
N#CC(=CN1CCCCCC1)S(=O)(=O)c1ccc(cc1)Cl
ZINC000005489101
ZINC05489101
ZINC5489101
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