Vitas-M small molecule compound
ethyl 2-{[({(4E)-1-(2-methylpropyl)-4-[(5-methylthiophen-2-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-4-phenylthiophene-3-carboxylate
Catalog ID
STK305249
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(=O)CSC1=N/C(=C/c2ccc(s2)C)/C(=O)N1CC(C)C
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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 C28H29N3O4S3 MW 567.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S3/c1-5-35-27(34)24-21(19-9-7-6-8-10-19)15-36-25(24)30-23(32)16-37-28-29-22(13-20-12-11-18(4)38-20)26(33)31(28)14-17(2)3/h6-13,15,17H,5,14,16H2,1-4H3,(H,30,32)/b22-13+InChIKey
VBVLJFRUSOJIAP-LPYMAVHISA-NSynonyms
753493-57-1753493571
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC(=CC4=CC=C(S4)C)C(=O)N3CC(C)C
CCOC(=O)c1c(scc1c1ccccc1)NC(=O)CSC1=NC(=Cc2ccc(s2)C)C(=O)N1CC(C)C
ethyl2(((((4E)1(2methylpropyl)4((5methylthiophen2yl)methylidene)5oxo45dihydro1Himidazol2yl)sulfanyl)acetyl)amino)4phenylthiophene3carboxylate
ethyl2((2((4E)1(2methylpropyl)4((5methylthiophen2yl)methylidene)5oxoimidazol2yl)sulfanylacetyl)amino)4phenylthiophene3carboxylate
InChI=1SC28H29N3O4S3c153527(34)2421(1997681019)153625(24)3023(32)1637282922(1320121118(4)3820)26(33)31(28)1417(2)3h6131517H51416H214H3(H3032)b2213+
MFCD04050321
ZINC000002785619
ZINC2785619
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