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

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]-2-phenyl-acetamide Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3OS/c20-15-9-6-10-16(18(15)23-11-4-5-12-23)21-19(25)22-17(24)13-14-7-2-1-3-8-14/h1-3,6-10H,4-5,11-13H2,(H2,21,22,24,25)