methyl 2-[[2,2,3,3,4,4,5,5-octakis(fluoranyl)-6-[(3-methoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-6-oxidanylidene-hexanoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2,2,3,3,4,4,5,5-octakis(fluoranyl)-6-[(3-methoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-6-oxidanylidene-hexanoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2,2,3,3,4,4,5,5-octafluoro-6-[(3-methoxycarbonyl-4-phenyl-2-thienyl)amino]-6-oxo-hexanoyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2,2,3,3,4,4,5,5-octafluoro-6-[(3-methoxycarbonyl-4-phenyl-2-thiophenyl)amino]-1,6-dioxohexyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2,2,3,3,4,4,5,5-octafluoro-6-[(3-methoxycarbonyl-4-phenylthiophen-2-yl)amino]-6-oxohexanoyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[6-[(3-carbomethoxy-4-phenyl-2-thienyl)amino]-2,2,3,3,4,4,5,5-octafluoro-6-keto-hexanoyl]amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C30H20F8N2O6S2 MolecularWeight: 720.606826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C(C(C(C(=O)NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)OC)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C(C(C(C(=O)NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)OC)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C30H20F8N2O6S2/c1-45-23(41)19-17(15-9-5-3-6-10-15)13-47-21(19)39-25(43)27(31,32)29(35,36)30(37,38)28(33,34)26(44)40-22-20(24(42)46-2)18(14-48-22)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,39,43)(H,40,44)