N-(2-phenoxyethyl)-N-[(6-sulfanylidenecyclohexa-1,3-dien-1-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(2-phenoxyethyl)-N-[(6-sulfanylidenecyclohexa-1,3-dien-1-yl)methyl]piperidine-4-carboxamide Openeye Name: N-(2-phenoxyethyl)-N-[(6-thioxocyclohexa-1,3-dien-1-yl)methyl]piperidine-4-carboxamide CAS Name: N-(2-phenoxyethyl)-N-[(6-sulfanylidene-1-cyclohexa-1,3-dienyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(2-phenoxyethyl)-N-[(6-sulfanylidenecyclohexa-1,3-dien-1-yl)methyl]piperidine-4-carboxamide Traditional Name: N-(2-phenoxyethyl)-N-[(6-thioxocyclohexa-1,3-dien-1-yl)methyl]isonipecotamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)N(CCOC2=CC=CC=C2)CC3=CC=CCC3=S

Isomeric SMILES

C1CNCCC1C(=O)N(CCOC2=CC=CC=C2)CC3=CC=CCC3=S

InChI

InChI=1S/C21H26N2O2S/c24-21(17-10-12-22-13-11-17)23(16-18-6-4-5-9-20(18)26)14-15-25-19-7-2-1-3-8-19/h1-8,17,22H,9-16H2