5-[[2-(1-benzofuran-2-ylcarbonylamino)-4-methyl-pentanoyl]amino]-2-methyl-N-(5-methyl-2-oxidanylidene-hexan-3-yl)-6-oxidanylidene-azepane-1-carboxamide

Systemtic Name: 5-[[2-(1-benzofuran-2-ylcarbonylamino)-4-methyl-pentanoyl]amino]-2-methyl-N-(5-methyl-2-oxidanylidene-hexan-3-yl)-6-oxidanylidene-azepane-1-carboxamide Openeye Name: N-(1-acetyl-3-methyl-butyl)-5-[[2-(benzofuran-2-carbonylamino)-4-methyl-pentanoyl]amino]-2-methyl-6-oxo-azepane-1-carboxamide CAS Name: 5-[[2-[[2-benzofuranyl(oxo)methyl]amino]-4-methyl-1-oxopentyl]amino]-2-methyl-N-(5-methyl-2-oxohexan-3-yl)-6-oxo-1-azepanecarboxamide IUPAC Name: 5-[[2-(1-benzofuran-2-carbonylamino)-4-methylpentanoyl]amino]-2-methyl-N-(5-methyl-2-oxohexan-3-yl)-6-oxoazepane-1-carboxamide Traditional Name: N-(1-acetyl-3-methyl-butyl)-5-[[2-(benzofuran-2-carbonylamino)-4-methyl-pentanoyl]amino]-6-keto-2-methyl-azepane-1-carboxamide Formula: C30H42N4O6 MolecularWeight: 554.67768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)CN1C(=O)NC(CC(C)C)C(=O)C)NC(=O)C(CC(C)C)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CC1CCC(C(=O)CN1C(=O)NC(CC(C)C)C(=O)C)NC(=O)C(CC(C)C)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C30H42N4O6/c1-17(2)13-23(20(6)35)33-30(39)34-16-25(36)22(12-11-19(34)5)31-28(37)24(14-18(3)4)32-29(38)27-15-21-9-7-8-10-26(21)40-27/h7-10,15,17-19,22-24H,11-14,16H2,1-6H3,(H,31,37)(H,32,38)(H,33,39)