4-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]-1,4-diazepane-1-carbaldehyde

Systemtic Name: 4-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]-1,4-diazepane-1-carbaldehyde Openeye Name: 4-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]-1,4-diazepane-1-carbaldehyde CAS Name: 4-[[3-(3-methylphenyl)-1-(4-methylphenyl)-4-pyrazolyl]methyl]-1,4-diazepane-1-carboxaldehyde IUPAC Name: 4-[[3-(3-methylphenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]-1,4-diazepane-1-carbaldehyde Traditional Name: 4-[[3-(m-tolyl)-1-(p-tolyl)pyrazol-4-yl]methyl]-1,4-diazepane-1-carbaldehyde Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)C)CN4CCCN(CC4)C=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)C)CN4CCCN(CC4)C=O

InChI

InChI=1S/C24H28N4O/c1-19-7-9-23(10-8-19)28-17-22(16-26-11-4-12-27(18-29)14-13-26)24(25-28)21-6-3-5-20(2)15-21/h3,5-10,15,17-18H,4,11-14,16H2,1-2H3