N-[2-cyanoethyl(phenyl)carbamothioyl]cyclopentanecarboxamide

Systemtic Name: N-[2-cyanoethyl(phenyl)carbamothioyl]cyclopentanecarboxamide Openeye Name: N-[2-cyanoethyl(phenyl)carbamothioyl]cyclopentanecarboxamide CAS Name: N-[[N-(2-cyanoethyl)anilino]-sulfanylidenemethyl]cyclopentanecarboxamide IUPAC Name: N-[2-cyanoethyl(phenyl)carbamothioyl]cyclopentanecarboxamide Traditional Name: N-[2-cyanoethyl(phenyl)thiocarbamoyl]cyclopentanecarboxamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC(=S)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

C1CCC(C1)C(=O)NC(=S)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C16H19N3OS/c17-11-6-12-19(14-9-2-1-3-10-14)16(21)18-15(20)13-7-4-5-8-13/h1-3,9-10,13H,4-8,12H2,(H,18,20,21)