3-[phenyl(pyrrolidin-1-ylsulfonyl)amino]propanethioamide

Systemtic Name: 3-[phenyl(pyrrolidin-1-ylsulfonyl)amino]propanethioamide Openeye Name: 3-(N-pyrrolidin-1-ylsulfonylanilino)propanethioamide CAS Name: 3-[N-(1-pyrrolidinylsulfonyl)anilino]propanethioamide IUPAC Name: 3-(N-pyrrolidin-1-ylsulfonylanilino)propanethioamide Traditional Name: 3-(N-pyrrolidinosulfonylanilino)thiopropionamide Formula: C13H19N3O2S2 MolecularWeight: 313.43886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)N(CCC(=S)N)C2=CC=CC=C2

Isomeric SMILES

C1CCN(C1)S(=O)(=O)N(CCC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C13H19N3O2S2/c14-13(19)8-11-16(12-6-2-1-3-7-12)20(17,18)15-9-4-5-10-15/h1-3,6-7H,4-5,8-11H2,(H2,14,19)