2-iodanyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-iodanyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 2-iodo-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 2-iodo-N-[[4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-iodo-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-iodo-N-[(4-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C18H18IN3OS MolecularWeight: 451.32449

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C18H18IN3OS/c19-16-6-2-1-5-15(16)17(23)21-18(24)20-13-7-9-14(10-8-13)22-11-3-4-12-22/h1-2,5-10H,3-4,11-12H2,(H2,20,21,23,24)