(E,4R)-N-(2-azanylethyl)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enamide

Systemtic Name: (E,4R)-N-(2-azanylethyl)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enamide Openeye Name: (E,4R)-N-(2-aminoethyl)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enamide CAS Name: (E,4R)-N-(2-aminoethyl)-4-[[oxo-(4-phenylanilino)methyl]amino]-5-phenyl-2-pentenamide IUPAC Name: (E,4R)-N-(2-aminoethyl)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enamide Traditional Name: (E,4R)-N-(2-aminoethyl)-5-phenyl-4-[(4-phenylphenyl)carbamoylamino]pent-2-enamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C=CC(=O)NCCN)NC(=O)NC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](/C=C/C(=O)NCCN)NC(=O)NC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H28N4O2/c27-17-18-28-25(31)16-15-24(19-20-7-3-1-4-8-20)30-26(32)29-23-13-11-22(12-14-23)21-9-5-2-6-10-21/h1-16,24H,17-19,27H2,(H,28,31)(H2,29,30,32)/b16-15+/t24-/m0/s1