azepan-1-yl-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-(1-benzyl-3-phenyl-pyrazol-4-yl)methanone CAS Name: 1-azepanyl-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-(1-benzyl-3-phenylpyrazol-4-yl)methanone Traditional Name: azepan-1-yl-(1-benzyl-3-phenyl-pyrazol-4-yl)methanone Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O/c27-23(25-15-9-1-2-10-16-25)21-18-26(17-19-11-5-3-6-12-19)24-22(21)20-13-7-4-8-14-20/h3-8,11-14,18H,1-2,9-10,15-17H2