2-[4-(2,5-dimethylfuran-3-yl)carbonyl-1,4-diazepan-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(2,5-dimethylfuran-3-yl)carbonyl-1,4-diazepan-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2,5-dimethylfuran-3-carbonyl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-[(2,5-dimethyl-3-furanyl)-oxomethyl]-1,4-diazepan-1-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2,5-dimethylfuran-3-carbonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(2,5-dimethyl-3-furoyl)-1,4-diazepan-1-yl]acetamide Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N2CCCN(CC2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N2CCCN(CC2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3/c1-16-13-19(17(2)27-16)21(26)24-10-6-9-23(11-12-24)15-20(25)22-14-18-7-4-3-5-8-18/h3-5,7-8,13H,6,9-12,14-15H2,1-2H3,(H,22,25)