4-bromanyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[(2-morpholinophenyl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[(2-morpholinophenyl)thiocarbamoyl]benzamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COCCN1C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrN3O2S/c19-14-7-5-13(6-8-14)17(23)21-18(25)20-15-3-1-2-4-16(15)22-9-11-24-12-10-22/h1-8H,9-12H2,(H2,20,21,23,25)