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

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]hexanamide Openeye Name: N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]hexanamide CAS Name: N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]hexanamide Traditional Name: N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]hexanamide Formula: C17H24ClN3OS MolecularWeight: 353.90996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=C(C(=CC=C1)Cl)N2CCCC2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=C(C(=CC=C1)Cl)N2CCCC2

InChI

InChI=1S/C17H24ClN3OS/c1-2-3-4-10-15(22)20-17(23)19-14-9-7-8-13(18)16(14)21-11-5-6-12-21/h7-9H,2-6,10-12H2,1H3,(H2,19,20,22,23)