N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(phenylmethyl)azepan-4-yl]amino]pentan-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-methyl-1-oxidanylidene-1-[[3-oxidanylidene-1-(phenylmethyl)azepan-4-yl]amino]pentan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[1-[(1-benzyl-3-oxo-azepan-4-yl)carbamoyl]-3-methyl-butyl]benzofuran-2-carboxamide CAS Name: N-[4-methyl-1-oxo-1-[[3-oxo-1-(phenylmethyl)-4-azepanyl]amino]pentan-2-yl]-2-benzofurancarboxamide IUPAC Name: N-[1-[(1-benzyl-3-oxoazepan-4-yl)amino]-4-methyl-1-oxopentan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-[(1-benzyl-3-keto-azepan-4-yl)carbamoyl]-3-methyl-butyl]coumarilamide Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCN(CC1=O)CC2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCN(CC1=O)CC2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C28H33N3O4/c1-19(2)15-23(30-28(34)26-16-21-11-6-7-13-25(21)35-26)27(33)29-22-12-8-14-31(18-24(22)32)17-20-9-4-3-5-10-20/h3-7,9-11,13,16,19,22-23H,8,12,14-15,17-18H2,1-2H3,(H,29,33)(H,30,34)