2-azanyl-N-[[(2S,5S)-5-(naphthalen-2-ylmethyl)-3,6-bis(oxidanylidene)-1-[(4-phenoxyphenyl)methyl]piperazin-2-yl]methyl]-N-(piperidin-4-ylmethyl)ethanamide

Systemtic Name: 2-azanyl-N-[[(2S,5S)-5-(naphthalen-2-ylmethyl)-3,6-bis(oxidanylidene)-1-[(4-phenoxyphenyl)methyl]piperazin-2-yl]methyl]-N-(piperidin-4-ylmethyl)ethanamide Openeye Name: 2-amino-N-[[(2S,5S)-5-(2-naphthylmethyl)-3,6-dioxo-1-[(4-phenoxyphenyl)methyl]piperazin-2-yl]methyl]-N-(4-piperidylmethyl)acetamide CAS Name: 2-amino-N-[[(2S,5S)-5-(2-naphthalenylmethyl)-3,6-dioxo-1-[(4-phenoxyphenyl)methyl]-2-piperazinyl]methyl]-N-(4-piperidinylmethyl)acetamide IUPAC Name: 2-amino-N-[[(2S,5S)-5-(naphthalen-2-ylmethyl)-3,6-dioxo-1-[(4-phenoxyphenyl)methyl]piperazin-2-yl]methyl]-N-(piperidin-4-ylmethyl)acetamide Traditional Name: 2-amino-N-[[(2S,5S)-3,6-diketo-5-(2-naphthylmethyl)-1-(4-phenoxybenzyl)piperazin-2-yl]methyl]-N-(4-piperidylmethyl)acetamide Formula: C37H41N5O4 MolecularWeight: 619.75254

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CN(CC2C(=O)NC(C(=O)N2CC3=CC=C(C=C3)OC4=CC=CC=C4)CC5=CC6=CC=CC=C6C=C5)C(=O)CN

Isomeric SMILES

C1CNCCC1CN(C[C@H]2C(=O)N[C@H](C(=O)N2CC3=CC=C(C=C3)OC4=CC=CC=C4)CC5=CC6=CC=CC=C6C=C5)C(=O)CN

InChI

InChI=1S/C37H41N5O4/c38-22-35(43)41(23-27-16-18-39-19-17-27)25-34-36(44)40-33(21-28-10-13-29-6-4-5-7-30(29)20-28)37(45)42(34)24-26-11-14-32(15-12-26)46-31-8-2-1-3-9-31/h1-15,20,27,33-34,39H,16-19,21-25,38H2,(H,40,44)/t33-,34-/m0/s1