1-[2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-(furan-2-carbonylamino)-4-methylsulfanyl-butanoyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[2-[[2-furanyl(oxo)methyl]amino]-4-(methylthio)-1-oxobutyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-(furan-2-carbonylamino)-4-methylsulfanylbutanoyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-(2-furoylamino)-4-(methylthio)butanoyl]-N-phenyl-isonipecotamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CSCCC(C(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H27N3O4S/c1-30-15-11-18(24-21(27)19-8-5-14-29-19)22(28)25-12-9-16(10-13-25)20(26)23-17-6-3-2-4-7-17/h2-8,14,16,18H,9-13,15H2,1H3,(H,23,26)(H,24,27)