N-[(3-bromophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[(3-bromophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[(3-bromophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[(3-bromoanilino)-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(3-bromophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[(3-bromophenyl)thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C22H19BrN2O3S MolecularWeight: 471.36686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H19BrN2O3S/c23-17-5-4-6-18(15-17)24-22(29)25-21(26)16-9-11-20(12-10-16)28-14-13-27-19-7-2-1-3-8-19/h1-12,15H,13-14H2,(H2,24,25,26,29)