N-[6-azanyl-1-[2-[4-azanyl-2-(1-azanyl-2-phenyl-ethyl)-5-cyclohexyl-2-oxidanyl-3-oxidanylidene-pentanoyl]pyrrolidin-1-yl]-1-oxidanylidene-hexan-2-yl]-2-(methylamino)-3-phenyl-propanamide

Systemtic Name: N-[6-azanyl-1-[2-[4-azanyl-2-(1-azanyl-2-phenyl-ethyl)-5-cyclohexyl-2-oxidanyl-3-oxidanylidene-pentanoyl]pyrrolidin-1-yl]-1-oxidanylidene-hexan-2-yl]-2-(methylamino)-3-phenyl-propanamide Openeye Name: N-[5-amino-1-[2-[4-amino-2-(1-amino-2-phenyl-ethyl)-5-cyclohexyl-2-hydroxy-3-oxo-pentanoyl]pyrrolidine-1-carbonyl]pentyl]-2-(methylamino)-3-phenyl-propanamide CAS Name: N-[6-amino-1-[2-[4-amino-2-(1-amino-2-phenylethyl)-5-cyclohexyl-2-hydroxy-1,3-dioxopentyl]-1-pyrrolidinyl]-1-oxohexan-2-yl]-2-(methylamino)-3-phenylpropanamide IUPAC Name: N-[6-amino-1-[2-[4-amino-2-(1-amino-2-phenylethyl)-5-cyclohexyl-2-hydroxy-3-oxopentanoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]-2-(methylamino)-3-phenylpropanamide Traditional Name: N-[5-amino-1-[2-[4-amino-2-(1-amino-2-phenyl-ethyl)-5-cyclohexyl-2-hydroxy-3-keto-pentanoyl]pyrrolidine-1-carbonyl]pentyl]-2-(methylamino)-3-phenyl-propionamide Formula: C39H58N6O5 MolecularWeight: 690.91502

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC=CC=C1)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)C(C(CC3=CC=CC=C3)N)(C(=O)C(CC4CCCCC4)N)O

Isomeric SMILES

CNC(CC1=CC=CC=C1)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)C(C(CC3=CC=CC=C3)N)(C(=O)C(CC4CCCCC4)N)O

InChI

InChI=1S/C39H58N6O5/c1-43-32(25-28-16-7-3-8-17-28)37(48)44-31(20-11-12-22-40)38(49)45-23-13-21-33(45)36(47)39(50,34(42)26-29-18-9-4-10-19-29)35(46)30(41)24-27-14-5-2-6-15-27/h3-4,7-10,16-19,27,30-34,43,50H,2,5-6,11-15,20-26,40-42H2,1H3,(H,44,48)