N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-heptyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-benzofuran-3-carboxamide

Systemtic Name: N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-heptyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-benzofuran-3-carboxamide Openeye Name: N-[1-[[1-(2-furylmethylsulfanyl)-2-oxo-heptyl]carbamoyl]-3-methyl-butyl]benzofuran-3-carboxamide CAS Name: N-[1-[[1-(2-furanylmethylthio)-2-oxoheptyl]amino]-4-methyl-1-oxopentan-2-yl]-3-benzofurancarboxamide IUPAC Name: N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxoheptyl]amino]-4-methyl-1-oxopentan-2-yl]-1-benzofuran-3-carboxamide Traditional Name: N-[1-[[1-(2-furfurylthio)-2-keto-heptyl]carbamoyl]-3-methyl-butyl]benzofuran-3-carboxamide Formula: C27H34N2O5S MolecularWeight: 498.63426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(NC(=O)C(CC(C)C)NC(=O)C1=COC2=CC=CC=C21)SCC3=CC=CO3

Isomeric SMILES

CCCCCC(=O)C(NC(=O)C(CC(C)C)NC(=O)C1=COC2=CC=CC=C21)SCC3=CC=CO3

InChI

InChI=1S/C27H34N2O5S/c1-4-5-6-12-23(30)27(35-17-19-10-9-14-33-19)29-26(32)22(15-18(2)3)28-25(31)21-16-34-24-13-8-7-11-20(21)24/h7-11,13-14,16,18,22,27H,4-6,12,15,17H2,1-3H3,(H,28,31)(H,29,32)