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

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[4-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-3-bromo-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[[4-[oxo-[(phenylmethyl)amino]methyl]anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-3-bromo-4-phenethyloxybenzamide Traditional Name: N-[[4-(benzylcarbamoyl)phenyl]thiocarbamoyl]-3-bromo-4-phenethyloxy-benzamide Formula: C30H26BrN3O3S MolecularWeight: 588.51474

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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)C(=O)NCC4=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)C(=O)NCC4=CC=CC=C4)Br

InChI

InChI=1S/C30H26BrN3O3S/c31-26-19-24(13-16-27(26)37-18-17-21-7-3-1-4-8-21)29(36)34-30(38)33-25-14-11-23(12-15-25)28(35)32-20-22-9-5-2-6-10-22/h1-16,19H,17-18,20H2,(H,32,35)(H2,33,34,36,38)