2-butyl-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-butyl-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-butyl-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-butyl-N-[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethyl]-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-butyl-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-butyl-N-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethyl]-7-methoxy-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C28H33N5O2 MolecularWeight: 471.59392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2=C(CC1C(=O)NCCC3=CN=CN3CC4=CC=C(C=C4)C#N)C=CC(=C2)OC

Isomeric SMILES

CCCCN1CC2=C(CC1C(=O)NCCC3=CN=CN3CC4=CC=C(C=C4)C#N)C=CC(=C2)OC

InChI

InChI=1S/C28H33N5O2/c1-3-4-13-32-19-24-14-26(35-2)10-9-23(24)15-27(32)28(34)31-12-11-25-17-30-20-33(25)18-22-7-5-21(16-29)6-8-22/h5-10,14,17,20,27H,3-4,11-13,15,18-19H2,1-2H3,(H,31,34)