Vitas-M small molecule compound
ethyl 4-{4-[(5Z)-5-(4-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperazine-1-carboxylate
Catalog ID
STK994371
SMILES CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCN(CC1)C(=O)OCC
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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 C23H29N3O5S2 MW 491.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O5S2/c1-3-30-18-9-7-17(8-10-18)16-19-21(28)26(23(32)33-19)11-5-6-20(27)24-12-14-25(15-13-24)22(29)31-4-2/h7-10,16H,3-6,11-15H2,1-2H3/b19-16-InChIKey
NTGCWASWLLVSIP-MNDPQUGUSA-NSynonyms
CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)N3CCN(CC3)C(=O)OCC
CCOc1ccc(cc1)C=C1SC(=S)N(C1=O)CCCC(=O)N1CCN(CC1)C(=O)OCC
ETHYL4(4((5Z)5((4ETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOYL)PIPERAZINE1CARBOXYLATE
ethyl4(4((5Z)5(4ethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)butanoyl)piperazine1carboxylate
InChI=1SC23H29N3O5S2c1330189717(81018)161921(28)26(23(32)3319)115620(27)24121425(151324)22(29)3142h71016H361115H212H3b1916
MFCD02365681
ZINC000013424550
ZINC13424550
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