2-[4-[2-azanyl-3-(4-fluorophenyl)propanoyl]-2-oxidanylidene-3-prop-2-enyl-piperazin-1-yl]-N-methyl-3-phenyl-propanamide

Systemtic Name: 2-[4-[2-azanyl-3-(4-fluorophenyl)propanoyl]-2-oxidanylidene-3-prop-2-enyl-piperazin-1-yl]-N-methyl-3-phenyl-propanamide Openeye Name: 2-[3-allyl-4-[2-amino-3-(4-fluorophenyl)propanoyl]-2-oxo-piperazin-1-yl]-N-methyl-3-phenyl-propanamide CAS Name: 2-[4-[2-amino-3-(4-fluorophenyl)-1-oxopropyl]-2-oxo-3-prop-2-enyl-1-piperazinyl]-N-methyl-3-phenylpropanamide IUPAC Name: 2-[4-[2-amino-3-(4-fluorophenyl)propanoyl]-2-oxo-3-prop-2-enylpiperazin-1-yl]-N-methyl-3-phenylpropanamide Traditional Name: 2-[3-allyl-4-[2-amino-3-(4-fluorophenyl)propanoyl]-2-keto-piperazino]-N-methyl-3-phenyl-propionamide Formula: C26H31FN4O3 MolecularWeight: 466.547743

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(CC1=CC=CC=C1)N2CCN(C(C2=O)CC=C)C(=O)C(CC3=CC=C(C=C3)F)N

Isomeric SMILES

CNC(=O)C(CC1=CC=CC=C1)N2CCN(C(C2=O)CC=C)C(=O)C(CC3=CC=C(C=C3)F)N

InChI

InChI=1S/C26H31FN4O3/c1-3-7-22-26(34)31(23(24(32)29-2)17-18-8-5-4-6-9-18)15-14-30(22)25(33)21(28)16-19-10-12-20(27)13-11-19/h3-6,8-13,21-23H,1,7,14-17,28H2,2H3,(H,29,32)