(2S)-N-[10-azanyl-10-azanylidene-1,4-bis(oxidanylidene)-1-piperidin-1-yl-decan-5-yl]-1-(2-azanyl-3-naphthalen-1-yl-propanoyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[10-azanyl-10-azanylidene-1,4-bis(oxidanylidene)-1-piperidin-1-yl-decan-5-yl]-1-(2-azanyl-3-naphthalen-1-yl-propanoyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[6-amino-6-imino-1-[4-oxo-4-(1-piperidyl)butanoyl]hexyl]-1-[2-amino-3-(1-naphthyl)propanoyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[10-amino-10-imino-1,4-dioxo-1-(1-piperidinyl)decan-5-yl]-1-[2-amino-3-(1-naphthalenyl)-1-oxopropyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(10-amino-10-imino-1,4-dioxo-1-piperidin-1-yldecan-5-yl)-1-(2-amino-3-naphthalen-1-ylpropanoyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[6-amino-6-imino-1-(4-keto-4-piperidino-butanoyl)hexyl]-1-[2-amino-3-(1-naphthyl)propanoyl]pyrrolidine-2-carboxamide Formula: C33H46N6O4 MolecularWeight: 590.75614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCC(=O)C(CCCCC(=N)N)NC(=O)C2CCCN2C(=O)C(CC3=CC=CC4=CC=CC=C43)N

Isomeric SMILES

C1CCN(CC1)C(=O)CCC(=O)C(CCCCC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)C(CC3=CC=CC4=CC=CC=C43)N

InChI

InChI=1S/C33H46N6O4/c34-26(22-24-12-8-11-23-10-2-3-13-25(23)24)33(43)39-21-9-15-28(39)32(42)37-27(14-4-5-16-30(35)36)29(40)17-18-31(41)38-19-6-1-7-20-38/h2-3,8,10-13,26-28H,1,4-7,9,14-22,34H2,(H3,35,36)(H,37,42)/t26?,27?,28-/m0/s1