3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(1,2-oxazol-3-ylmethylamino)piperidin-1-yl]phenyl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(1,2-oxazol-3-ylmethylamino)piperidin-1-yl]phenyl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(isoxazol-3-ylmethylamino)-1-piperidyl]phenyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-isoxazolylmethylamino)-1-piperidinyl]phenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(1,2-oxazol-3-ylmethylamino)piperidin-1-yl]phenyl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(isoxazol-3-ylmethylamino)piperidino]phenyl]methanone Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2=NOC=C2)C3=CC=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CN(CCC1NCC2=NOC=C2)C3=CC=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H28N4O2/c30-25(29-13-9-19-3-1-2-4-21(19)18-29)20-5-7-24(8-6-20)28-14-10-22(11-15-28)26-17-23-12-16-31-27-23/h1-8,12,16,22,26H,9-11,13-15,17-18H2