N1-[4-(2-hydroxyethylamino)-3-oxidanyl-5-oxidanylidene-5-(phenethylamino)-1-phenyl-pentan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[4-(2-hydroxyethylamino)-3-oxidanyl-5-oxidanylidene-5-(phenethylamino)-1-phenyl-pentan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[1-benzyl-2-hydroxy-3-(2-hydroxyethylamino)-4-oxo-4-(phenethylamino)butyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[3-hydroxy-4-(2-hydroxyethylamino)-5-oxo-5-(phenethylamino)-1-phenylpentan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[3-hydroxy-4-(2-hydroxyethylamino)-5-oxo-5-(phenethylamino)-1-phenylpentan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[1-benzyl-2-hydroxy-3-(2-hydroxyethylamino)-4-keto-4-(phenethylamino)butyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C36H48N4O5 MolecularWeight: 616.79012

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(C(C(=O)NCCC3=CC=CC=C3)NCCO)O)C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(C(C(=O)NCCC3=CC=CC=C3)NCCO)O)C

InChI

InChI=1S/C36H48N4O5/c1-4-19-40(20-5-2)36(45)30-23-26(3)22-29(25-30)34(43)39-31(24-28-14-10-7-11-15-28)33(42)32(37-18-21-41)35(44)38-17-16-27-12-8-6-9-13-27/h6-15,22-23,25,31-33,37,41-42H,4-5,16-21,24H2,1-3H3,(H,38,44)(H,39,43)