1-[3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]-3-(1H-pyrazol-4-yl)propan-1-one

Systemtic Name: 1-[3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]-3-(1H-pyrazol-4-yl)propan-1-one Openeye Name: 1-[3-(4-isopropylanilino)-1-piperidyl]-3-(1H-pyrazol-4-yl)propan-1-one CAS Name: 1-[3-(4-propan-2-ylanilino)-1-piperidinyl]-3-(1H-pyrazol-4-yl)-1-propanone IUPAC Name: 1-[3-(4-propan-2-ylanilino)piperidin-1-yl]-3-(1H-pyrazol-4-yl)propan-1-one Traditional Name: 1-(3-cumidinopiperidino)-3-(1H-pyrazol-4-yl)propan-1-one Formula: C20H28N4O MolecularWeight: 340.46252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)CCC3=CNN=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)CCC3=CNN=C3

InChI

InChI=1S/C20H28N4O/c1-15(2)17-6-8-18(9-7-17)23-19-4-3-11-24(14-19)20(25)10-5-16-12-21-22-13-16/h6-9,12-13,15,19,23H,3-5,10-11,14H2,1-2H3,(H,21,22)