N-[2-(ethanethioylamino)phenyl]-N-(1-phenethylpiperidin-4-yl)cyclopropanecarboxamide

Systemtic Name: N-[2-(ethanethioylamino)phenyl]-N-(1-phenethylpiperidin-4-yl)cyclopropanecarboxamide Openeye Name: N-[2-(ethanethioylamino)phenyl]-N-(1-phenethyl-4-piperidyl)cyclopropanecarboxamide CAS Name: N-(1-phenethyl-4-piperidinyl)-N-[2-(1-sulfanylideneethylamino)phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-(ethanethioylamino)phenyl]-N-(1-phenethylpiperidin-4-yl)cyclopropanecarboxamide Traditional Name: N-(1-phenethyl-4-piperidyl)-N-[2-(thioacetylamino)phenyl]cyclopropanecarboxamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NC1=CC=CC=C1N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)C4CC4

Isomeric SMILES

CC(=S)NC1=CC=CC=C1N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)C4CC4

InChI

InChI=1S/C25H31N3OS/c1-19(30)26-23-9-5-6-10-24(23)28(25(29)21-11-12-21)22-14-17-27(18-15-22)16-13-20-7-3-2-4-8-20/h2-10,21-22H,11-18H2,1H3,(H,26,30)