3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-oxidanylidene-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-oxidanylidene-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]-4-isoquinolinecarboxamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-keto-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Formula: C35H33N3O2 MolecularWeight: 527.65542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C(N(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)CN5CCC6=CC=CC=C6C5

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C(N(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)CN5CCC6=CC=CC=C6C5

InChI

InChI=1S/C35H33N3O2/c1-2-31(26-14-5-3-6-15-26)36-34(39)33-29-19-11-12-20-30(29)35(40)38(28-17-7-4-8-18-28)32(33)24-37-22-21-25-13-9-10-16-27(25)23-37/h3-20,31H,2,21-24H2,1H3,(H,36,39)/t31-/m0/s1