3-carbamimidoyl-N-[(1R)-2-oxidanylidene-1-phenyl-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]benzamide

Systemtic Name: 3-carbamimidoyl-N-[(1R)-2-oxidanylidene-1-phenyl-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]benzamide Openeye Name: N-[(1R)-2-(4-benzyl-1-piperidyl)-2-oxo-1-phenyl-ethyl]-3-carbamimidoyl-benzamide CAS Name: 3-carbamimidoyl-N-[(1R)-2-oxo-1-phenyl-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]benzamide IUPAC Name: N-[(1R)-2-(4-benzylpiperidin-1-yl)-2-oxo-1-phenylethyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[(1R)-2-(4-benzylpiperidino)-2-keto-1-phenyl-ethyl]benzamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)NC(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)[C@@H](C3=CC=CC=C3)NC(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C28H30N4O2/c29-26(30)23-12-7-13-24(19-23)27(33)31-25(22-10-5-2-6-11-22)28(34)32-16-14-21(15-17-32)18-20-8-3-1-4-9-20/h1-13,19,21,25H,14-18H2,(H3,29,30)(H,31,33)/t25-/m1/s1