N-[2-(azepan-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[2-(1-azepanyl)phenyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O/c29-24(15-14-20-18-25-28(19-20)21-10-4-3-5-11-21)26-22-12-6-7-13-23(22)27-16-8-1-2-9-17-27/h3-7,10-13,18-19H,1-2,8-9,14-17H2,(H,26,29)