5-cyano-N-methyl-5-phenyl-2-pyrrolidin-1-yl-cyclohexene-1-carbothioamide

Systemtic Name: 5-cyano-N-methyl-5-phenyl-2-pyrrolidin-1-yl-cyclohexene-1-carbothioamide Openeye Name: 5-cyano-N-methyl-5-phenyl-2-pyrrolidin-1-yl-cyclohexene-1-carbothioamide CAS Name: 5-cyano-N-methyl-5-phenyl-2-(1-pyrrolidinyl)-1-cyclohexenecarbothioamide IUPAC Name: 5-cyano-N-methyl-5-phenyl-2-pyrrolidin-1-ylcyclohexene-1-carbothioamide Traditional Name: 5-cyano-N-methyl-5-phenyl-2-pyrrolidino-cyclohexene-1-carbothioamide Formula: C19H23N3S MolecularWeight: 325.47102

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1=C(CCC(C1)(C#N)C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CNC(=S)C1=C(CCC(C1)(C#N)C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C19H23N3S/c1-21-18(23)16-13-19(14-20,15-7-3-2-4-8-15)10-9-17(16)22-11-5-6-12-22/h2-4,7-8H,5-6,9-13H2,1H3,(H,21,23)