[5-[3-[[4-[(5-chloranylthiophen-2-yl)carbonylamino]-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]-2-fluoranyl-phenyl]methylcarbamic acid

Systemtic Name: [5-[3-[[4-[(5-chloranylthiophen-2-yl)carbonylamino]-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]-2-fluoranyl-phenyl]methylcarbamic acid Openeye Name: [5-[3-[[4-[(5-chlorothiophene-2-carbonyl)amino]-1,3-dioxo-isoindolin-2-yl]methyl]phenyl]-2-fluoro-phenyl]methylcarbamic acid CAS Name: [5-[3-[[4-[[(5-chloro-2-thiophenyl)-oxomethyl]amino]-1,3-dioxo-2-isoindolyl]methyl]phenyl]-2-fluorophenyl]methylcarbamic acid IUPAC Name: [5-[3-[[4-[(5-chlorothiophene-2-carbonyl)amino]-1,3-dioxoisoindol-2-yl]methyl]phenyl]-2-fluorophenyl]methylcarbamic acid Traditional Name: [5-[3-[[4-[(5-chlorothiophene-2-carbonyl)amino]-1,3-diketo-isoindolin-2-yl]methyl]phenyl]-2-fluoro-benzyl]carbamic acid Formula: C28H19ClFN3O5S MolecularWeight: 563.983963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C4=CC=C(S4)Cl)C5=CC(=C(C=C5)F)CNC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C4=CC=C(S4)Cl)C5=CC(=C(C=C5)F)CNC(=O)O

InChI

InChI=1S/C28H19ClFN3O5S/c29-23-10-9-22(39-23)25(34)32-21-6-2-5-19-24(21)27(36)33(26(19)35)14-15-3-1-4-16(11-15)17-7-8-20(30)18(12-17)13-31-28(37)38/h1-12,31H,13-14H2,(H,32,34)(H,37,38)