Vitas-M small molecule compound

2-[(1E)-3-amino-2-cyano-3-oxoprop-1-en-1-yl]phenyl naphthalene-2-sulfonate

Catalog ID
STK362103
SMILES N#C/C(=C\c1ccccc1OS(=O)(=O)c1ccc2c(c1)cccc2)/C(=O)N

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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 C20H14N2O4S MW 378.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O4S/c21-13-17(20(22)23)11-16-7-3-4-8-19(16)26-27(24,25)18-10-9-14-5-1-2-6-15(14)12-18/h1-12H,(H2,22,23)/b17-11+
InChIKey
SVAMVDHSEBVAON-GZTJUZNOSA-N
Synonyms
355395-03-8
(2((E)3AMINO2CYANO3OXOPROP1ENYL)PHENYL)NAPHTHALENE2SULFONATE
2((1E)3AMINO2CYANO3OXOPROP1EN1YL)PHENYLNAPHTHALENE2SULFONATE
355395038
C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)OC3=CC=CC=C3C=C(C#N)C(=O)N
InChI=1SC20H14N2O4Sc211317(20(22)23)1116734819(16)2627(2425)1810914512615(14)1218h112H(H22223)b1711+
MFCD02104616
N#CC(=Cc1ccccc1OS(=O)(=O)c1ccc2c(c1)cccc2)C(=O)N
ZINC000004503946
ZINC04503946
ZINC4503946

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Available files

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