Vitas-M small molecule compound
{3-[(Z)-{5-[(4-chlorophenyl)amino]-4-(ethoxycarbonyl)-3-oxothiophen-2(3H)-ylidene}methyl]-1H-indol-1-yl}acetic acid
Catalog ID
STL417348
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C\c2cn(c3c2cccc3)CC(=O)O)/C1=O
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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 C24H19ClN2O5S MW 482.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O5S/c1-2-32-24(31)21-22(30)19(33-23(21)26-16-9-7-15(25)8-10-16)11-14-12-27(13-20(28)29)18-6-4-3-5-17(14)18/h3-12,26H,2,13H2,1H3,(H,28,29)/b19-11-InChIKey
DDWOKZHYMZEYEV-ODLFYWEKSA-NSynonyms
(3((Z)(5((4chlorophenyl)amino)4(ethoxycarbonyl)3oxothiophen2(3H)ylidene)methyl)1Hindol1yl)aceticacid
2(3((Z)(5(4CHLOROANILINO)4ETHOXYCARBONYL3OXOTHIOPHEN2YLIDENE)METHYL)INDOL1YL)ACETICACID
CCOC(=O)C1=C(Nc2ccc(cc2)Cl)SC(=Cc2cn(c3c2cccc3)CC(=O)O)C1=O
CCOC(=O)C1=C(SC(=CC2=CN(C3=CC=CC=C32)CC(=O)O)C1=O)NC4=CC=C(C=C4)Cl
InChI=1SC24H19ClN2O5Sc123224(31)2122(30)19(3323(21)26169715(25)81016)11141227(1320(28)29)18643517(14)18h31226H213H21H3(H2829)b1911
MFCD05150053
ZINC000100333953
ZINC100333953
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