Vitas-M small molecule compound
ethyl 2-{[({(4E)-1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-4-phenylthiophene-3-carboxylate
Catalog ID
STK305317
SMILES COCCCN1C(=N/C(=C/c2cnn(c2)C)/C1=O)SCC(=O)Nc1scc(c1C(=O)OCC)c1ccccc1
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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 C27H29N5O5S2 MW 567.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O5S2/c1-4-37-26(35)23-20(19-9-6-5-7-10-19)16-38-24(23)30-22(33)17-39-27-29-21(13-18-14-28-31(2)15-18)25(34)32(27)11-8-12-36-3/h5-7,9-10,13-16H,4,8,11-12,17H2,1-3H3,(H,30,33)/b21-13+InChIKey
PXHGKLJCCMWOSV-FYJGNVAPSA-NSynonyms
1005660-79-61005660796
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CSC3=NC(=CC4=CN(N=C4)C)C(=O)N3CCCOC
COCCCN1C(=NC(=Cc2cnn(c2)C)C1=O)SCC(=O)Nc1scc(c1C(=O)OCC)c1ccccc1
ethyl2(((((4E)1(3methoxypropyl)4((1methyl1Hpyrazol4yl)methylidene)5oxo45dihydro1Himidazol2yl)sulfanyl)acetyl)amino)4phenylthiophene3carboxylate
ethyl2((2((4E)1(3methoxypropyl)4((1methylpyrazol4yl)methylidene)5oxoimidazol2yl)sulfanylacetyl)amino)4phenylthiophene3carboxylate
InChI=1SC27H29N5O5S2c143726(35)2320(1996571019)163824(23)3022(33)1739272921(1318142831(2)1518)25(34)32(27)11812363h579101316H48111217H213H3(H3033)b2113+
MFCD04050327
ZINC000102000752
ZINC102000752
Check stock
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