N-(4-bromanyl-2-methyl-phenyl)-2-[(1-chloranylisoquinolin-3-yl)-methyl-amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[(1-chloranylisoquinolin-3-yl)-methyl-amino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(1-chloro-3-isoquinolyl)-methyl-amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[(1-chloro-3-isoquinolinyl)-methylamino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(1-chloroisoquinolin-3-yl)-methylamino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(1-chloro-3-isoquinolyl)-methyl-amino]acetamide Formula: C19H17BrClN3O MolecularWeight: 418.71478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C2=CC3=CC=CC=C3C(=N2)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C2=CC3=CC=CC=C3C(=N2)Cl

InChI

InChI=1S/C19H17BrClN3O/c1-12-9-14(20)7-8-16(12)22-18(25)11-24(2)17-10-13-5-3-4-6-15(13)19(21)23-17/h3-10H,11H2,1-2H3,(H,22,25)