Vitas-M small molecule compound
methyl 4-chloro-2-{[(Z)-2-cyano-2-(phenylsulfonyl)ethenyl]amino}benzoate
Catalog ID
STK716011
SMILES COC(=O)c1ccc(cc1N/C=C(\S(=O)(=O)c1ccccc1)/C#N)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 C17H13ClN2O4S MW 376.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN2O4S/c1-24-17(21)15-8-7-12(18)9-16(15)20-11-14(10-19)25(22,23)13-5-3-2-4-6-13/h2-9,11,20H,1H3/b14-11-InChIKey
CLPCNCXRQXJPEC-KAMYIIQDSA-NSynonyms
COC(=O)C1=C(C=C(C=C1)Cl)NC=C(C#N)S(=O)(=O)C2=CC=CC=C2
COC(=O)c1ccc(cc1NC=C(S(=O)(=O)c1ccccc1)C#N)Cl
InChI=1SC17H13ClN2O4Sc12417(21)158712(18)916(15)201114(1019)25(2223)135324613h291120H1H3b1411
methyl2(((Z)2(benzenesulfonyl)2cyanoethenyl)amino)4chlorobenzoate
methyl4chloro2(((Z)2cyano2(phenylsulfonyl)ethenyl)amino)benzoate
methyl4chloro2((2cyano2(phenylsulfonyl)vinyl)amino)benzoate
MFCD10040289
ZINC000101427332
ZINC101427332
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