Vitas-M small molecule compound
diethyl 2,2'-[(1-oxo-2,2-diphenylethane-1,2-diyl)diimino]bis(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate)
Catalog ID
STK430431
SMILES CCOC(=O)c1c(sc2c1CCC(C2)C)NC(=O)C(c1ccccc1)(c1ccccc1)Nc1sc2c(c1C(=O)OCC)CCC(C2)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 C38H42N2O5S2 MW 670.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H42N2O5S2/c1-5-44-35(41)31-27-19-17-23(3)21-29(27)46-33(31)39-37(43)38(25-13-9-7-10-14-25,26-15-11-8-12-16-26)40-34-32(36(42)45-6-2)28-20-18-24(4)22-30(28)47-34/h7-16,23-24,40H,5-6,17-22H2,1-4H3,(H,39,43)InChIKey
IPXVSQVDPVQXTK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)NC5=C(C6=C(S5)CC(CC6)C)C(=O)OCC
diethyl22((1oxo22diphenylethane12diyl)diimino)bis(6methyl4567tetrahydro1benzothiophene3carboxylate)
ethyl2((2((3ethoxycarbonyl6methyl4567tetrahydro1benzothiophen2yl)amino)22diphenylacetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC38H42N2O5S2c154435(41)3127191723(3)2129(27)4633(31)3937(43)38(2513971014252615118121626)403432(36(42)4562)28201824(4)2230(28)4734h716232440H561722H214H3(H3943)
MFCD03465524
ZINC000097949215
ZINC000097949218
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