(2R)-2-[5-(2-cycloheptylethanoylamino)-1-oxidanylidene-isoquinolin-2-yl]-N-cyclopropyl-3-methyl-butanamide

Systemtic Name: (2R)-2-[5-(2-cycloheptylethanoylamino)-1-oxidanylidene-isoquinolin-2-yl]-N-cyclopropyl-3-methyl-butanamide Openeye Name: (2R)-2-[5-[(2-cycloheptylacetyl)amino]-1-oxo-2-isoquinolyl]-N-cyclopropyl-3-methyl-butanamide CAS Name: (2R)-2-[5-[(2-cycloheptyl-1-oxoethyl)amino]-1-oxo-2-isoquinolinyl]-N-cyclopropyl-3-methylbutanamide IUPAC Name: (2R)-2-[5-[(2-cycloheptylacetyl)amino]-1-oxoisoquinolin-2-yl]-N-cyclopropyl-3-methylbutanamide Traditional Name: (2R)-2-[5-[(2-cycloheptylacetyl)amino]-1-keto-2-isoquinolyl]-N-cyclopropyl-3-methyl-butyramide Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CC1)N2C=CC3=C(C2=O)C=CC=C3NC(=O)CC4CCCCCC4

Isomeric SMILES

CC(C)[C@H](C(=O)NC1CC1)N2C=CC3=C(C2=O)C=CC=C3NC(=O)CC4CCCCCC4

InChI

InChI=1S/C26H35N3O3/c1-17(2)24(25(31)27-19-12-13-19)29-15-14-20-21(26(29)32)10-7-11-22(20)28-23(30)16-18-8-5-3-4-6-9-18/h7,10-11,14-15,17-19,24H,3-6,8-9,12-13,16H2,1-2H3,(H,27,31)(H,28,30)/t24-/m1/s1