(5-tert-butyl-2-methyl-pyrazol-3-yl)-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-tert-butyl-2-methyl-pyrazol-3-yl)-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (5-tert-butyl-2-methyl-pyrazol-3-yl)-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (5-tert-butyl-2-methyl-3-pyrazolyl)-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (5-tert-butyl-2-methylpyrazol-3-yl)-[4-[(4-tert-butylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: [4-(4-tert-butylbenzyl)-1,4-diazepan-1-yl]-(5-tert-butyl-2-methyl-pyrazol-3-yl)methanone Formula: C25H38N4O MolecularWeight: 410.59542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NN3C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NN3C)C(C)(C)C

InChI

InChI=1S/C25H38N4O/c1-24(2,3)20-11-9-19(10-12-20)18-28-13-8-14-29(16-15-28)23(30)21-17-22(25(4,5)6)26-27(21)7/h9-12,17H,8,13-16,18H2,1-7H3