N-(3-isoquinolin-7-yl-4-methyl-phenyl)-4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)benzamide

Systemtic Name: N-(3-isoquinolin-7-yl-4-methyl-phenyl)-4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)benzamide Openeye Name: N-[3-(7-isoquinolyl)-4-methyl-phenyl]-4-(morpholinomethyl)-3-(trifluoromethyl)benzamide CAS Name: N-[3-(7-isoquinolinyl)-4-methylphenyl]-4-(4-morpholinylmethyl)-3-(trifluoromethyl)benzamide IUPAC Name: N-(3-isoquinolin-7-yl-4-methylphenyl)-4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)benzamide Traditional Name: N-[3-(7-isoquinolyl)-4-methyl-phenyl]-4-(morpholinomethyl)-3-(trifluoromethyl)benzamide Formula: C29H26F3N3O2 MolecularWeight: 505.53085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CCOCC3)C(F)(F)F)C4=CC5=C(C=C4)C=CN=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CCOCC3)C(F)(F)F)C4=CC5=C(C=C4)C=CN=C5

InChI

InChI=1S/C29H26F3N3O2/c1-19-2-7-25(16-26(19)21-4-3-20-8-9-33-17-24(20)14-21)34-28(36)22-5-6-23(27(15-22)29(30,31)32)18-35-10-12-37-13-11-35/h2-9,14-17H,10-13,18H2,1H3,(H,34,36)