N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-2-fluoro-benzamide CAS Name: N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]-2-fluorobenzamide Traditional Name: N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]-2-fluoro-benzamide Formula: C18H17ClFN3OS MolecularWeight: 377.863483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H17ClFN3OS/c19-13-7-5-9-15(16(13)23-10-3-4-11-23)21-18(25)22-17(24)12-6-1-2-8-14(12)20/h1-2,5-9H,3-4,10-11H2,(H2,21,22,24,25)