3-bromanyl-4-phenethyloxy-N-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamothioyl]-3-bromo-4-phenethyloxy-benzamide CAS Name: N-[[2-[(4-anilinoanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-bromo-4-phenethyloxybenzamide IUPAC Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamothioyl]-3-bromo-4-phenethyloxybenzamide Traditional Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]thiocarbamoyl]-3-bromo-4-phenethyloxy-benzamide Formula: C35H29BrN4O3S MolecularWeight: 665.59876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)NC5=CC=CC=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)NC5=CC=CC=C5)Br

InChI

InChI=1S/C35H29BrN4O3S/c36-30-23-25(15-20-32(30)43-22-21-24-9-3-1-4-10-24)33(41)40-35(44)39-31-14-8-7-13-29(31)34(42)38-28-18-16-27(17-19-28)37-26-11-5-2-6-12-26/h1-20,23,37H,21-22H2,(H,38,42)(H2,39,40,41,44)