N-[4-(azepan-1-yl)phenyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[4-(1-azepanyl)phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O/c27-22(18-16-23-26(17-18)21-8-4-3-5-9-21)24-19-10-12-20(13-11-19)25-14-6-1-2-7-15-25/h3-5,8-13,16-17H,1-2,6-7,14-15H2,(H,24,27)