2-[4-[2-azanyl-3-(4-fluorophenyl)propanoyl]-2-oxidanylidene-3-propyl-piperazin-1-yl]-3-(4-methylphenyl)-N-propan-2-yl-propanamide

Systemtic Name: 2-[4-[2-azanyl-3-(4-fluorophenyl)propanoyl]-2-oxidanylidene-3-propyl-piperazin-1-yl]-3-(4-methylphenyl)-N-propan-2-yl-propanamide Openeye Name: 2-[4-[2-amino-3-(4-fluorophenyl)propanoyl]-2-oxo-3-propyl-piperazin-1-yl]-N-isopropyl-3-(p-tolyl)propanamide CAS Name: 2-[4-[2-amino-3-(4-fluorophenyl)-1-oxopropyl]-2-oxo-3-propyl-1-piperazinyl]-3-(4-methylphenyl)-N-propan-2-ylpropanamide IUPAC Name: 2-[4-[2-amino-3-(4-fluorophenyl)propanoyl]-2-oxo-3-propylpiperazin-1-yl]-3-(4-methylphenyl)-N-propan-2-ylpropanamide Traditional Name: 2-[4-[2-amino-3-(4-fluorophenyl)propanoyl]-2-keto-3-propyl-piperazino]-N-isopropyl-3-(p-tolyl)propionamide Formula: C29H39FN4O3 MolecularWeight: 510.643363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(CCN1C(=O)C(CC2=CC=C(C=C2)F)N)C(CC3=CC=C(C=C3)C)C(=O)NC(C)C

Isomeric SMILES

CCCC1C(=O)N(CCN1C(=O)C(CC2=CC=C(C=C2)F)N)C(CC3=CC=C(C=C3)C)C(=O)NC(C)C

InChI

InChI=1S/C29H39FN4O3/c1-5-6-25-29(37)34(26(27(35)32-19(2)3)18-22-9-7-20(4)8-10-22)16-15-33(25)28(36)24(31)17-21-11-13-23(30)14-12-21/h7-14,19,24-26H,5-6,15-18,31H2,1-4H3,(H,32,35)