4-bromanyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[[2-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 4-bromo-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[(2-piperidinophenyl)thiocarbamoyl]benzamide Formula: C19H20BrN3OS MolecularWeight: 418.3506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H20BrN3OS/c20-15-10-8-14(9-11-15)18(24)22-19(25)21-16-6-2-3-7-17(16)23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-13H2,(H2,21,22,24,25)