1-[4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoyl]piperidine-4-carboxamide Openeye Name: 1-[4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoyl]piperidine-4-carboxamide CAS Name: 1-[4-(methylthio)-1-oxo-2-[(1-oxo-2-phenoxyethyl)amino]butyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoyl]piperidine-4-carboxamide Traditional Name: 1-[4-(methylthio)-2-[(2-phenoxyacetyl)amino]butanoyl]isonipecotamide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCC(CC1)C(=O)N)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)N1CCC(CC1)C(=O)N)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C19H27N3O4S/c1-27-12-9-16(19(25)22-10-7-14(8-11-22)18(20)24)21-17(23)13-26-15-5-3-2-4-6-15/h2-6,14,16H,7-13H2,1H3,(H2,20,24)(H,21,23)