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

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-phenethyloxy-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-3-bromo-4-phenethyloxybenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-phenethyloxybenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-3-bromo-4-phenethyloxy-benzamide Formula: C28H24BrN3O2S MolecularWeight: 546.47806

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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=C(C=C3)NC4=CC=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC4=CC=CC=C4)Br

InChI

InChI=1S/C28H24BrN3O2S/c29-25-19-21(11-16-26(25)34-18-17-20-7-3-1-4-8-20)27(33)32-28(35)31-24-14-12-23(13-15-24)30-22-9-5-2-6-10-22/h1-16,19,30H,17-18H2,(H2,31,32,33,35)