(2S)-N-[10-azanyl-10-azanylidene-1,4-bis(oxidanylidene)-1-piperidin-1-yl-decan-5-yl]-1-(2-azanyl-3-naphthalen-2-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-2-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-(2-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-(2-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-2-ylpropanoyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[6-amino-6-imino-1-(4-keto-4-piperidino-butanoyl)hexyl]-1-[2-amino-3-(2-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=CC4=CC=CC=C4C=C3)N

Isomeric SMILES

C1CCN(CC1)C(=O)CCC(=O)C(CCCCC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)C(CC3=CC4=CC=CC=C4C=C3)N

InChI

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