N-[[3-[(4-fluorophenyl)sulfonylamino]-4-methoxy-phenyl]carbamothioyl]-4-phenoxy-benzamide

Systemtic Name: N-[[3-[(4-fluorophenyl)sulfonylamino]-4-methoxy-phenyl]carbamothioyl]-4-phenoxy-benzamide Openeye Name: N-[[3-[(4-fluorophenyl)sulfonylamino]-4-methoxy-phenyl]carbamothioyl]-4-phenoxy-benzamide CAS Name: N-[[3-[(4-fluorophenyl)sulfonylamino]-4-methoxyanilino]-sulfanylidenemethyl]-4-phenoxybenzamide IUPAC Name: N-[[3-[(4-fluorophenyl)sulfonylamino]-4-methoxyphenyl]carbamothioyl]-4-phenoxybenzamide Traditional Name: N-[[3-[(4-fluorophenyl)sulfonylamino]-4-methoxy-phenyl]thiocarbamoyl]-4-phenoxy-benzamide Formula: C27H22FN3O5S2 MolecularWeight: 551.609083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H22FN3O5S2/c1-35-25-16-11-20(17-24(25)31-38(33,34)23-14-9-19(28)10-15-23)29-27(37)30-26(32)18-7-12-22(13-8-18)36-21-5-3-2-4-6-21/h2-17,31H,1H3,(H2,29,30,32,37)