5-bromanyl-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[(4-indolin-1-ylsulfonylphenyl)carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[(4-indolin-1-ylsulfonylphenyl)thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C30H26BrN3O4S2 MolecularWeight: 636.57914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC(=O)C4=C(C=CC(=C4)Br)OCCC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC(=O)C4=C(C=CC(=C4)Br)OCCC5=CC=CC=C5

InChI

InChI=1S/C30H26BrN3O4S2/c31-23-10-15-28(38-19-17-21-6-2-1-3-7-21)26(20-23)29(35)33-30(39)32-24-11-13-25(14-12-24)40(36,37)34-18-16-22-8-4-5-9-27(22)34/h1-15,20H,16-19H2,(H2,32,33,35,39)