Vitas-M small molecule compound
4-{[(2E)-2-cyano-3-(4-{[(4-methoxyphenyl)sulfonyl]oxy}phenyl)prop-2-enoyl]amino}benzoic acid
Catalog ID
STK054347
SMILES COc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)/C=C(/C(=O)Nc1ccc(cc1)C(=O)O)\C#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 C24H18N2O7S MW 478.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O7S/c1-32-20-10-12-22(13-11-20)34(30,31)33-21-8-2-16(3-9-21)14-18(15-25)23(27)26-19-6-4-17(5-7-19)24(28)29/h2-14H,1H3,(H,26,27)(H,28,29)/b18-14+InChIKey
UFDKRHMWLLFFSZ-NBVRZTHBSA-NSynonyms
4(((2E)2CYANO3(4(((4METHOXYPHENYL)SULFONYL)OXY)PHENYL)PROP2ENOYL)AMINO)BENZOICACID
4(((E)2CYANO3(4(4METHOXYPHENYL)SULFONYLOXYPHENYL)PROP2ENOYL)AMINO)BENZOICACID
COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)O
COc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C=C(C(=O)Nc1ccc(cc1)C(=O)O)C#N
InChI=1SC24H18N2O7Sc13220101222(131120)34(3031)33218216(3921)1418(1525)23(27)26196417(5719)24(28)29h214H1H3(H2627)(H2829)b1814+
MFCD03208049
STK054347
ZINC000013943948
ZINC13943948
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