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

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]ethanamide Openeye Name: N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]acetamide CAS Name: N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]acetamide Formula: C13H16ClN3OS MolecularWeight: 297.80364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3OS/c1-9(18)15-13(19)16-11-6-4-5-10(14)12(11)17-7-2-3-8-17/h4-6H,2-3,7-8H2,1H3,(H2,15,16,18,19)