3-[(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)-phenyl-amino]propanethioamide

Systemtic Name: 3-[(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)-phenyl-amino]propanethioamide Openeye Name: 3-(N-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)anilino)propanethioamide CAS Name: 3-(N-[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]anilino)propanethioamide IUPAC Name: 3-(N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)anilino)propanethioamide Traditional Name: 3-(N-(2-keto-1-methyl-2-pyrrolidino-ethyl)anilino)thiopropionamide Formula: C16H23N3OS MolecularWeight: 305.43832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)N(CCC(=S)N)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N1CCCC1)N(CCC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C16H23N3OS/c1-13(16(20)18-10-5-6-11-18)19(12-9-15(17)21)14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3,(H2,17,21)