Vitas-M small molecule compound
methyl (2E)-3-[(4-bromophenyl)amino]-2-[(4-methylphenyl)sulfonyl]prop-2-enoate
Catalog ID
STL133316
SMILES COC(=O)/C(=C\Nc1ccc(cc1)Br)/S(=O)(=O)c1ccc(cc1)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 C17H16BrNO4S MW 410.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrNO4S/c1-12-3-9-15(10-4-12)24(21,22)16(17(20)23-2)11-19-14-7-5-13(18)6-8-14/h3-11,19H,1-2H3/b16-11+InChIKey
DTAQMPZRHNNVQE-LFIBNONCSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)Br)C(=O)OC
COC(=O)C(=CNc1ccc(cc1)Br)S(=O)(=O)c1ccc(cc1)C
InChI=1SC17H16BrNO4Sc1123915(10412)24(2122)16(17(20)232)1119147513(18)6814h31119H12H3b1611+
methyl(2E)3((4bromophenyl)amino)2((4methylphenyl)sulfonyl)prop2enoate
methyl(E)3(4bromoanilino)2(4methylphenyl)sulfonylprop2enoate
MFCD20753636
ZINC000067340498
ZINC67340498
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