N-[6-azanyl-1-oxidanylidene-1-(4-piperidin-1-ylpiperidin-1-yl)hexan-2-yl]-N-(2-azanyl-3-phenyl-propanoyl)-4-(2-oxidanylidene-5-phenyl-1H-imidazol-3-yl)piperidine-1-carboxamide

Systemtic Name: N-[6-azanyl-1-oxidanylidene-1-(4-piperidin-1-ylpiperidin-1-yl)hexan-2-yl]-N-(2-azanyl-3-phenyl-propanoyl)-4-(2-oxidanylidene-5-phenyl-1H-imidazol-3-yl)piperidine-1-carboxamide Openeye Name: N-(2-amino-3-phenyl-propanoyl)-N-[5-amino-1-[4-(1-piperidyl)piperidine-1-carbonyl]pentyl]-4-(2-oxo-5-phenyl-1H-imidazol-3-yl)piperidine-1-carboxamide CAS Name: N-(2-amino-1-oxo-3-phenylpropyl)-N-[6-amino-1-oxo-1-[4-(1-piperidinyl)-1-piperidinyl]hexan-2-yl]-4-(2-oxo-5-phenyl-1H-imidazol-3-yl)-1-piperidinecarboxamide IUPAC Name: N-[6-amino-1-oxo-1-(4-piperidin-1-ylpiperidin-1-yl)hexan-2-yl]-N-(2-amino-3-phenylpropanoyl)-4-(2-oxo-5-phenyl-1H-imidazol-3-yl)piperidine-1-carboxamide Traditional Name: N-[5-amino-1-(4-piperidinopiperidine-1-carbonyl)pentyl]-4-(2-keto-4-phenyl-4-imidazolin-1-yl)-N-phenylalanyl-piperidine-1-carboxamide Formula: C40H56N8O4 MolecularWeight: 712.92384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)C(CCCCN)N(C(=O)C(CC3=CC=CC=C3)N)C(=O)N4CCC(CC4)N5C=C(NC5=O)C6=CC=CC=C6

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)C(CCCCN)N(C(=O)C(CC3=CC=CC=C3)N)C(=O)N4CCC(CC4)N5C=C(NC5=O)C6=CC=CC=C6

InChI

InChI=1S/C40H56N8O4/c41-21-9-8-16-36(38(50)45-24-17-32(18-25-45)44-22-10-3-11-23-44)48(37(49)34(42)28-30-12-4-1-5-13-30)40(52)46-26-19-33(20-27-46)47-29-35(43-39(47)51)31-14-6-2-7-15-31/h1-2,4-7,12-15,29,32-34,36H,3,8-11,16-28,41-42H2,(H,43,51)