Vitas-M small molecule compound
[(5Z)-5-(4-{2-[(2-methylphenyl)amino]-2-oxoethoxy}benzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL428680
SMILES O=C(Nc1ccccc1C)COc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)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 C21H18N2O5S2 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5S2/c1-13-4-2-3-5-16(13)22-18(24)12-28-15-8-6-14(7-9-15)10-17-20(27)23(11-19(25)26)21(29)30-17/h2-10H,11-12H2,1H3,(H,22,24)(H,25,26)/b17-10-InChIKey
PRNNINPATXQQGI-YVLHZVERSA-NSynonyms
((5Z)5(4(2((2methylphenyl)amino)2oxoethoxy)benzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((4(2(2methylanilino)2oxoethoxy)phenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
CC1=CC=CC=C1NC(=O)COC2=CC=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O
InChI=1SC21H18N2O5S2c113423516(13)2218(24)1228158614(7915)101720(27)23(1119(25)26)21(29)3017h210H1112H21H3(H2224)(H2526)b1710
MFCD30710634
O=C(Nc1ccccc1C)COc1ccc(cc1)C=C1SC(=S)N(C1=O)CC(=O)O
ZINC000108534909
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