(2S)-2-(1-benzofuran-5-ylsulfonylamino)-4-methyl-N-[(3-methylimidazol-4-yl)methyl]-N-(2-methylpropyl)pentanamide

Systemtic Name: (2S)-2-(1-benzofuran-5-ylsulfonylamino)-4-methyl-N-[(3-methylimidazol-4-yl)methyl]-N-(2-methylpropyl)pentanamide Openeye Name: (2S)-2-(benzofuran-5-ylsulfonylamino)-N-isobutyl-4-methyl-N-[(3-methylimidazol-4-yl)methyl]pentanamide CAS Name: (2S)-2-(5-benzofuranylsulfonylamino)-4-methyl-N-[(3-methyl-4-imidazolyl)methyl]-N-(2-methylpropyl)pentanamide IUPAC Name: (2S)-2-(1-benzofuran-5-ylsulfonylamino)-4-methyl-N-[(3-methylimidazol-4-yl)methyl]-N-(2-methylpropyl)pentanamide Traditional Name: (2S)-2-(benzofuran-5-ylsulfonylamino)-N-isobutyl-4-methyl-N-[(3-methylimidazol-4-yl)methyl]valeramide Formula: C23H32N4O4S MolecularWeight: 460.58958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(CC1=CN=CN1C)CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OC=C3

Isomeric SMILES

CC(C)C[C@@H](C(=O)N(CC1=CN=CN1C)CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OC=C3

InChI

InChI=1S/C23H32N4O4S/c1-16(2)10-21(23(28)27(13-17(3)4)14-19-12-24-15-26(19)5)25-32(29,30)20-6-7-22-18(11-20)8-9-31-22/h6-9,11-12,15-17,21,25H,10,13-14H2,1-5H3/t21-/m0/s1