3-[7-[3-(dimethylamino)propyl]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-N-(1,2-oxazol-3-yl)benzamide

Systemtic Name: 3-[7-[3-(dimethylamino)propyl]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-N-(1,2-oxazol-3-yl)benzamide Openeye Name: 3-[7-[3-(dimethylamino)propyl]-1-oxo-2-isoquinolyl]-N-isoxazol-3-yl-4-methyl-benzamide CAS Name: 3-[7-[3-(dimethylamino)propyl]-1-oxo-2-isoquinolinyl]-N-(3-isoxazolyl)-4-methylbenzamide IUPAC Name: 3-[7-[3-(dimethylamino)propyl]-1-oxoisoquinolin-2-yl]-4-methyl-N-(1,2-oxazol-3-yl)benzamide Traditional Name: 3-[7-[3-(dimethylamino)propyl]-1-keto-2-isoquinolyl]-N-isoxazol-3-yl-4-methyl-benzamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NOC=C2)N3C=CC4=C(C3=O)C=C(C=C4)CCCN(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NOC=C2)N3C=CC4=C(C3=O)C=C(C=C4)CCCN(C)C

InChI

InChI=1S/C25H26N4O3/c1-17-6-8-20(24(30)26-23-11-14-32-27-23)16-22(17)29-13-10-19-9-7-18(5-4-12-28(2)3)15-21(19)25(29)31/h6-11,13-16H,4-5,12H2,1-3H3,(H,26,27,30)