N-[3-methyl-1-oxidanylidene-1-[(3-oxidanylidene-1-pyridin-2-ylcarbonyl-azepan-4-yl)amino]butan-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[(3-oxidanylidene-1-pyridin-2-ylcarbonyl-azepan-4-yl)amino]butan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methyl-1-[[3-oxo-1-(pyridine-2-carbonyl)azepan-4-yl]carbamoyl]propyl]benzofuran-2-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[[3-oxo-1-[oxo(2-pyridinyl)methyl]-4-azepanyl]amino]butan-2-yl]-2-benzofurancarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[[3-oxo-1-(pyridine-2-carbonyl)azepan-4-yl]amino]butan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-[(3-keto-1-picolinoyl-azepan-4-yl)carbamoyl]-2-methyl-propyl]coumarilamide Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCCN(CC1=O)C(=O)C2=CC=CC=N2)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(C)C(C(=O)NC1CCCN(CC1=O)C(=O)C2=CC=CC=N2)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C26H28N4O5/c1-16(2)23(29-24(32)22-14-17-8-3-4-11-21(17)35-22)25(33)28-18-10-7-13-30(15-20(18)31)26(34)19-9-5-6-12-27-19/h3-6,8-9,11-12,14,16,18,23H,7,10,13,15H2,1-2H3,(H,28,33)(H,29,32)