(2S)-4-(dimethylamino)-N-isoquinolin-6-yl-2-phenyl-butanamide

Systemtic Name: (2S)-4-(dimethylamino)-N-isoquinolin-6-yl-2-phenyl-butanamide Openeye Name: (2S)-4-(dimethylamino)-N-(6-isoquinolyl)-2-phenyl-butanamide CAS Name: (2S)-4-(dimethylamino)-N-(6-isoquinolinyl)-2-phenylbutanamide IUPAC Name: (2S)-4-(dimethylamino)-N-isoquinolin-6-yl-2-phenylbutanamide Traditional Name: (2S)-4-(dimethylamino)-N-(6-isoquinolyl)-2-phenyl-butyramide Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C=NC=C3

Isomeric SMILES

CN(C)CC[C@@H](C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C=NC=C3

InChI

InChI=1S/C21H23N3O/c1-24(2)13-11-20(16-6-4-3-5-7-16)21(25)23-19-9-8-18-15-22-12-10-17(18)14-19/h3-10,12,14-15,20H,11,13H2,1-2H3,(H,23,25)/t20-/m0/s1