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

Systemtic Name: 4-chloranyl-N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]benzamide Formula: C18H17Cl2N3OS MolecularWeight: 394.31808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Cl2N3OS/c19-13-8-6-12(7-9-13)17(24)22-18(25)21-15-5-3-4-14(20)16(15)23-10-1-2-11-23/h3-9H,1-2,10-11H2,(H2,21,22,24,25)