N-ethanoyl-N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-heptan-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]piperidine-4-carboxamide

Systemtic Name: N-ethanoyl-N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-heptan-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]piperidine-4-carboxamide Openeye Name: N-acetyl-N-[1-[1-[2-(2-furylmethylsulfanyl)acetyl]pentylcarbamoyl]-3-methyl-butyl]piperidine-4-carboxamide CAS Name: N-acetyl-N-[1-[[1-(2-furanylmethylthio)-2-oxoheptan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]-4-piperidinecarboxamide IUPAC Name: N-acetyl-N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxoheptan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]piperidine-4-carboxamide Traditional Name: N-acetyl-N-[1-[1-[2-(2-furfurylthio)acetyl]pentylcarbamoyl]-3-methyl-butyl]isonipecotamide Formula: C26H41N3O5S MolecularWeight: 507.68584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CSCC1=CC=CO1)NC(=O)C(CC(C)C)N(C(=O)C)C(=O)C2CCNCC2

Isomeric SMILES

CCCCC(C(=O)CSCC1=CC=CO1)NC(=O)C(CC(C)C)N(C(=O)C)C(=O)C2CCNCC2

InChI

InChI=1S/C26H41N3O5S/c1-5-6-9-22(24(31)17-35-16-21-8-7-14-34-21)28-25(32)23(15-18(2)3)29(19(4)30)26(33)20-10-12-27-13-11-20/h7-8,14,18,20,22-23,27H,5-6,9-13,15-17H2,1-4H3,(H,28,32)