Vitas-M small molecule compound

2-[(5Z)-5-(1-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid

Catalog ID
STK702822
SMILES CCOc1ccc(cc1)NC(=O)CN1c2ccccc2/C(=C\2/SC(=S)N(C2=O)CCS(=O)(=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 C23H21N3O7S3 MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O7S3/c1-2-33-15-9-7-14(8-10-15)24-18(27)13-26-17-6-4-3-5-16(17)19(21(26)28)20-22(29)25(23(34)35-20)11-12-36(30,31)32/h3-10H,2,11-13H2,1H3,(H,24,27)(H,30,31,32)/b20-19-
InChIKey
MHXKNDMOMWMKKU-VXPUYCOJSA-N
Synonyms

(Z)2(5(1(2((4ethoxyphenyl)amino)2oxoethyl)2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)ethanesulfonicacid
2((5Z)5(1(2((4ethoxyphenyl)amino)2oxoethyl)2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)ethanesulfonicacid
2((5Z)5(1(2(4ETHOXYANILINO)2OXOETHYL)2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ETHANESULFONICACID
CCOC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CCS(=O)(=O)O)C2=O
CCOc1ccc(cc1)NC(=O)CN1c2ccccc2C(=C2SC(=S)N(C2=O)CCS(=O)(=O)O)C1=O
InChI=1SC23H21N3O7S3c1233159714(81015)2418(27)132617643516(17)19(21(26)28)2022(29)25(23(34)3520)111236(3031)32h310H21113H21H3(H2427)(H303132)b2019
MFCD02987272
ZINC000100722297
ZINC100722297

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Available files

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