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

Systemtic Name: N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-heptyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[1-[[1-(2-furylmethylsulfanyl)-2-oxo-heptyl]carbamoyl]-3-methyl-butyl]benzofuran-2-carboxamide CAS Name: N-[1-[[1-(2-furanylmethylthio)-2-oxoheptyl]amino]-4-methyl-1-oxopentan-2-yl]-2-benzofurancarboxamide IUPAC Name: N-[1-[[1-(furan-2-ylmethylsulfanyl)-2-oxoheptyl]amino]-4-methyl-1-oxopentan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-[[1-(2-furfurylthio)-2-keto-heptyl]carbamoyl]-3-methyl-butyl]coumarilamide 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=CC2=CC=CC=C2O1)SCC3=CC=CO3

Isomeric SMILES

CCCCCC(=O)C(NC(=O)C(CC(C)C)NC(=O)C1=CC2=CC=CC=C2O1)SCC3=CC=CO3

InChI

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