N-butyl-5-oxidanylidene-1-(2-phenylethanoyl)-6-(phenylmethyl)-3-[(4-phenylphenyl)methyl]piperazine-2-carboxamide

Systemtic Name: N-butyl-5-oxidanylidene-1-(2-phenylethanoyl)-6-(phenylmethyl)-3-[(4-phenylphenyl)methyl]piperazine-2-carboxamide Openeye Name: 6-benzyl-N-butyl-5-oxo-1-(2-phenylacetyl)-3-[(4-phenylphenyl)methyl]piperazine-2-carboxamide CAS Name: N-butyl-5-oxo-1-(1-oxo-2-phenylethyl)-6-(phenylmethyl)-3-[(4-phenylphenyl)methyl]-2-piperazinecarboxamide IUPAC Name: 6-benzyl-N-butyl-5-oxo-1-(2-phenylacetyl)-3-[(4-phenylphenyl)methyl]piperazine-2-carboxamide Traditional Name: 6-benzyl-N-butyl-5-keto-1-(2-phenylacetyl)-3-(4-phenylbenzyl)piperazine-2-carboxamide Formula: C37H39N3O3 MolecularWeight: 573.72386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1C(NC(=O)C(N1C(=O)CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCNC(=O)C1C(NC(=O)C(N1C(=O)CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H39N3O3/c1-2-3-23-38-37(43)35-32(24-29-19-21-31(22-20-29)30-17-11-6-12-18-30)39-36(42)33(25-27-13-7-4-8-14-27)40(35)34(41)26-28-15-9-5-10-16-28/h4-22,32-33,35H,2-3,23-26H2,1H3,(H,38,43)(H,39,42)