N-[(1S)-1-cyclohexylethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(1S)-1-cyclohexylethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-cyclohexylethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(1S)-1-cyclohexylethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(1S)-1-cyclohexylethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-phenylquinoline-4-carboxamide Traditional Name: N-[(1S)-1-cyclohexylethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-phenyl-cinchoninamide Formula: C34H37N3O MolecularWeight: 503.67708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCC6=CC=CC=C6C5

Isomeric SMILES

C[C@@H](C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CN5CCC6=CC=CC=C6C5

InChI

InChI=1S/C34H37N3O/c1-24(25-12-4-2-5-13-25)35-34(38)32-29-18-10-11-19-31(29)36-33(27-15-6-3-7-16-27)30(32)23-37-21-20-26-14-8-9-17-28(26)22-37/h3,6-11,14-19,24-25H,2,4-5,12-13,20-23H2,1H3,(H,35,38)/t24-/m0/s1