Vitas-M small molecule compound
6-[(5Z)-5-(1-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK813320
SMILES COc1ccc(cc1)NC(=O)CN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCCCCC(=O)O)/c2c1cccc2
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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 C26H25N3O6S2 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O6S2/c1-35-17-12-10-16(11-13-17)27-20(30)15-29-19-8-5-4-7-18(19)22(24(29)33)23-25(34)28(26(36)37-23)14-6-2-3-9-21(31)32/h4-5,7-8,10-13H,2-3,6,9,14-15H2,1H3,(H,27,30)(H,31,32)/b23-22-InChIKey
VTLYAPQSPYIRQU-FCQUAONHSA-NSynonyms
6((5Z)5(1(2((4methoxyphenyl)amino)2oxoethyl)2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5(1(2(4METHOXYANILINO)2OXOETHYL)2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
6(5(1(2((4METHOXYPHENYL)AMINO)2OXOETHYL)2OXOINDOLIN3YLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)HEXANOICACID
COC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CCCCCC(=O)O)C2=O
COc1ccc(cc1)NC(=O)CN1C(=O)C(=C2SC(=S)N(C2=O)CCCCCC(=O)O)c2c1cccc2
InChI=1SC26H25N3O6S2c13517121016(111317)2720(30)152919854718(19)22(24(29)33)2325(34)28(26(36)3723)14623921(31)32h45781013H23691415H21H3(H2730)(H3132)b2322
MFCD04441491
ZINC000100871320
ZINC100871320
Check stock
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Check stock on Vitas-MAvailable files
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