N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]carbamimidoyl]-2-oxidanylidene-imidazolidine-4-carboxamide

Systemtic Name: N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]carbamimidoyl]-2-oxidanylidene-imidazolidine-4-carboxamide Openeye Name: N-[N-(2-methylbenzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]carbamimidoyl]-2-oxo-imidazolidine-4-carboxamide CAS Name: N-[[(2-methyl-5-benzofuranyl)amino]-[[2-oxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-azepanyl]imino]methyl]-2-oxo-4-imidazolidinecarboxamide IUPAC Name: N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]-2-oxoimidazolidine-4-carboxamide Traditional Name: 2-keto-N-[N'-[2-keto-1-(2-keto-2-pyrrolidino-ethyl)azepan-3-yl]-N-(2-methylbenzofuran-5-yl)amidino]imidazolidine-4-carboxamide Formula: C26H33N7O5 MolecularWeight: 523.58412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(O1)C=CC(=C2)NC(=NC3CCCCN(C3=O)CC(=O)N4CCCC4)NC(=O)C5CNC(=O)N5

Isomeric SMILES

CC1=CC2=C(O1)C=CC(=C2)NC(=NC3CCCCN(C3=O)CC(=O)N4CCCC4)NC(=O)C5CNC(=O)N5

InChI

InChI=1S/C26H33N7O5/c1-16-12-17-13-18(7-8-21(17)38-16)28-25(31-23(35)20-14-27-26(37)30-20)29-19-6-2-3-11-33(24(19)36)15-22(34)32-9-4-5-10-32/h7-8,12-13,19-20H,2-6,9-11,14-15H2,1H3,(H2,27,30,37)(H2,28,29,31,35)