2,4-dimethyl-N-[1-[4-[(4-phenyl-1,4-diazepan-1-yl)carbonyl]phenyl]pyrazol-4-yl]benzamide

Systemtic Name: 2,4-dimethyl-N-[1-[4-[(4-phenyl-1,4-diazepan-1-yl)carbonyl]phenyl]pyrazol-4-yl]benzamide Openeye Name: 2,4-dimethyl-N-[1-[4-(4-phenyl-1,4-diazepane-1-carbonyl)phenyl]pyrazol-4-yl]benzamide CAS Name: 2,4-dimethyl-N-[1-[4-[oxo-(4-phenyl-1,4-diazepan-1-yl)methyl]phenyl]-4-pyrazolyl]benzamide IUPAC Name: 2,4-dimethyl-N-[1-[4-(4-phenyl-1,4-diazepane-1-carbonyl)phenyl]pyrazol-4-yl]benzamide Traditional Name: 2,4-dimethyl-N-[1-[4-(4-phenyl-1,4-diazepane-1-carbonyl)phenyl]pyrazol-4-yl]benzamide Formula: C30H31N5O2 MolecularWeight: 493.59944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=CN(N=C2)C3=CC=C(C=C3)C(=O)N4CCCN(CC4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CN(N=C2)C3=CC=C(C=C3)C(=O)N4CCCN(CC4)C5=CC=CC=C5)C

InChI

InChI=1S/C30H31N5O2/c1-22-9-14-28(23(2)19-22)29(36)32-25-20-31-35(21-25)27-12-10-24(11-13-27)30(37)34-16-6-15-33(17-18-34)26-7-4-3-5-8-26/h3-5,7-14,19-21H,6,15-18H2,1-2H3,(H,32,36)