3-carbamimidoyl-N-[(1R)-2-oxidanylidene-1-phenyl-2-[(4S)-4-(phenylcarbonyl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzamide

Systemtic Name: 3-carbamimidoyl-N-[(1R)-2-oxidanylidene-1-phenyl-2-[(4S)-4-(phenylcarbonyl)-3,4-dihydro-2H-pyridin-1-yl]ethyl]benzamide Openeye Name: N-[(1R)-2-[(4S)-4-benzoyl-3,4-dihydro-2H-pyridin-1-yl]-2-oxo-1-phenyl-ethyl]-3-carbamimidoyl-benzamide CAS Name: N-[(1R)-2-[(4S)-4-benzoyl-3,4-dihydro-2H-pyridin-1-yl]-2-oxo-1-phenylethyl]-3-carbamimidoylbenzamide IUPAC Name: N-[(1R)-2-[(4S)-4-benzoyl-3,4-dihydro-2H-pyridin-1-yl]-2-oxo-1-phenylethyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[(1R)-2-[(4S)-4-benzoyl-3,4-dihydro-2H-pyridin-1-yl]-2-keto-1-phenyl-ethyl]benzamide Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C=CC1C(=O)C2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(C=C[C@H]1C(=O)C2=CC=CC=C2)C(=O)[C@@H](C3=CC=CC=C3)NC(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C28H26N4O3/c29-26(30)22-12-7-13-23(18-22)27(34)31-24(19-8-3-1-4-9-19)28(35)32-16-14-21(15-17-32)25(33)20-10-5-2-6-11-20/h1-14,16,18,21,24H,15,17H2,(H3,29,30)(H,31,34)/t21-,24-/m1/s1