N1,N1-diethyl-N4-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-1,4-dicarboxamide

Systemtic Name: N1,N1-diethyl-N4-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-1,4-dicarboxamide Openeye Name: N1,N1-diethyl-N4-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]piperidine-1,4-dicarboxamide CAS Name: N1,N1-diethyl-N4-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-1,4-dicarboxamide IUPAC Name: 1-N,1-N-diethyl-4-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]piperidine-1,4-dicarboxamide Traditional Name: N,N-diethyl-N'-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]piperidine-1,4-dicarboxamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)N3C=CNC3=S

Isomeric SMILES

CCN(CC)C(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)N3C=CNC3=S

InChI

InChI=1S/C20H27N5O2S/c1-3-23(4-2)20(27)24-11-8-15(9-12-24)18(26)22-16-6-5-7-17(14-16)25-13-10-21-19(25)28/h5-7,10,13-15H,3-4,8-9,11-12H2,1-2H3,(H,21,28)(H,22,26)