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

Systemtic Name: 4-[(4-tert-butylphenyl)methyl]-1-[(5-methyl-1H-imidazol-4-yl)methyl]-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine Openeye Name: 4-[(4-tert-butylphenyl)methyl]-1-[(5-methyl-1H-imidazol-4-yl)methyl]-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine CAS Name: 4-[(4-tert-butylphenyl)methyl]-1-[(5-methyl-1H-imidazol-4-yl)methyl]-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine IUPAC Name: 4-[(4-tert-butylphenyl)methyl]-1-[(5-methyl-1H-imidazol-4-yl)methyl]-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine Traditional Name: 4-(4-tert-butylbenzyl)-1-[(5-methyl-1H-imidazol-4-yl)methyl]-2-phenethyl-3,5-dihydro-2H-1,4-benzodiazepine Formula: C33H40N4 MolecularWeight: 492.6975

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN2C(CN(CC3=CC=CC=C32)CC4=CC=C(C=C4)C(C)(C)C)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(N=CN1)CN2C(CN(CC3=CC=CC=C32)CC4=CC=C(C=C4)C(C)(C)C)CCC5=CC=CC=C5

InChI

InChI=1S/C33H40N4/c1-25-31(35-24-34-25)23-37-30(19-16-26-10-6-5-7-11-26)22-36(21-28-12-8-9-13-32(28)37)20-27-14-17-29(18-15-27)33(2,3)4/h5-15,17-18,24,30H,16,19-23H2,1-4H3,(H,34,35)