4-[2-[(3-fluorophenyl)carbonylamino]-3-phenyl-propanoyl]-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-[2-[(3-fluorophenyl)carbonylamino]-3-phenyl-propanoyl]-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-[2-[(3-fluorobenzoyl)amino]-3-phenyl-propanoyl]piperazine-1-carboxamide CAS Name: 4-[2-[[(3-fluorophenyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-[2-[(3-fluorobenzoyl)amino]-3-phenylpropanoyl]piperazine-1-carboxamide Traditional Name: N-benzyl-4-[2-[(3-fluorobenzoyl)amino]-3-phenyl-propanoyl]piperazine-1-carboxamide Formula: C28H29FN4O3 MolecularWeight: 488.553263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)F)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)F)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H29FN4O3/c29-24-13-7-12-23(19-24)26(34)31-25(18-21-8-3-1-4-9-21)27(35)32-14-16-33(17-15-32)28(36)30-20-22-10-5-2-6-11-22/h1-13,19,25H,14-18,20H2,(H,30,36)(H,31,34)