4-[(4-tert-butylphenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine

Systemtic Name: 4-[(4-tert-butylphenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine Openeye Name: 4-[(4-tert-butylphenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine CAS Name: 4-[(4-tert-butylphenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine IUPAC Name: 4-[(4-tert-butylphenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine Traditional Name: 4-(4-tert-butylbenzyl)-1-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine Formula: C32H38N4 MolecularWeight: 478.67092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CC(N(C3=CC=CC=C3C2)CC4=CN=CN4)CCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CC(N(C3=CC=CC=C3C2)CC4=CN=CN4)CCC5=CC=CC=C5

InChI

InChI=1S/C32H38N4/c1-32(2,3)28-16-13-26(14-17-28)20-35-21-27-11-7-8-12-31(27)36(22-29-19-33-24-34-29)30(23-35)18-15-25-9-5-4-6-10-25/h4-14,16-17,19,24,30H,15,18,20-23H2,1-3H3,(H,33,34)