N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1-(furan-2-ylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1-(furan-2-ylcarbonyl)piperidine-4-carboxamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-1-(furan-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-1-[2-furanyl(oxo)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-1-(furan-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-1-(2-furoyl)isonipecotamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2SCC(=O)N)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2SCC(=O)N)C(=O)C3=CC=CO3

InChI

InChI=1S/C19H21N3O4S/c20-17(23)12-27-16-6-2-1-4-14(16)21-18(24)13-7-9-22(10-8-13)19(25)15-5-3-11-26-15/h1-6,11,13H,7-10,12H2,(H2,20,23)(H,21,24)