N-[3-[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,2-oxazol-3-yl]phenyl]-2-methyl-quinolin-4-amine

Systemtic Name: N-[3-[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,2-oxazol-3-yl]phenyl]-2-methyl-quinolin-4-amine Openeye Name: N-[3-[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)isoxazol-3-yl]phenyl]-2-methyl-quinolin-4-amine CAS Name: N-[3-[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-isoxazolyl]phenyl]-2-methyl-4-quinolinamine IUPAC Name: N-[3-[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,2-oxazol-3-yl]phenyl]-2-methylquinolin-4-amine Traditional Name: [3-[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)isoxazol-3-yl]phenyl]-(2-methyl-4-quinolyl)amine Formula: C29H26N4O MolecularWeight: 446.54294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC3=CC=CC(=C3)C4=NOC(=C4)CN5CCC6=CC=CC=C6C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC3=CC=CC(=C3)C4=NOC(=C4)CN5CCC6=CC=CC=C6C5

InChI

InChI=1S/C29H26N4O/c1-20-15-29(26-11-4-5-12-27(26)30-20)31-24-10-6-9-22(16-24)28-17-25(34-32-28)19-33-14-13-21-7-2-3-8-23(21)18-33/h2-12,15-17H,13-14,18-19H2,1H3,(H,30,31)