(2Z)-N-methyl-2-pyrrolidin-1-ylimino-1-quinolin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: (2Z)-N-methyl-2-pyrrolidin-1-ylimino-1-quinolin-3-yl-cyclohexane-1-carbothioamide Openeye Name: (2Z)-N-methyl-2-pyrrolidin-1-ylimino-1-(3-quinolyl)cyclohexanecarbothioamide CAS Name: (2Z)-N-methyl-2-(1-pyrrolidinylimino)-1-(3-quinolinyl)-1-cyclohexanecarbothioamide IUPAC Name: (2Z)-N-methyl-2-pyrrolidin-1-ylimino-1-quinolin-3-ylcyclohexane-1-carbothioamide Traditional Name: (2Z)-N-methyl-2-pyrrolidinoimino-1-(3-quinolyl)cyclohexanecarbothioamide Formula: C21H26N4S MolecularWeight: 366.52294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(CCCCC1=NN2CCCC2)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CNC(=S)C\1(CCCC/C1=N/N2CCCC2)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H26N4S/c1-22-20(26)21(17-14-16-8-2-3-9-18(16)23-15-17)11-5-4-10-19(21)24-25-12-6-7-13-25/h2-3,8-9,14-15H,4-7,10-13H2,1H3,(H,22,26)/b24-19-