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

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-1-benzyl-pyrazole-4-carboxamide CAS Name: N-[4-(1-azepanyl)phenyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-1-benzylpyrazole-4-carboxamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-1-benzyl-pyrazole-4-carboxamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O/c28-23(20-16-24-27(18-20)17-19-8-4-3-5-9-19)25-21-10-12-22(13-11-21)26-14-6-1-2-7-15-26/h3-5,8-13,16,18H,1-2,6-7,14-15,17H2,(H,25,28)