N-[1-azanyl-3-(3-methyl-4-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl]-2-[(2-azanyl-3-phenyl-propanoyl)-methyl-amino]-N,3-dimethyl-butanamide

Systemtic Name: N-[1-azanyl-3-(3-methyl-4-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl]-2-[(2-azanyl-3-phenyl-propanoyl)-methyl-amino]-N,3-dimethyl-butanamide Openeye Name: N-[2-amino-1-[(4-hydroxy-3-methyl-phenyl)methyl]-2-oxo-ethyl]-2-[(2-amino-3-phenyl-propanoyl)-methyl-amino]-N,3-dimethyl-butanamide CAS Name: N-[1-amino-3-(4-hydroxy-3-methylphenyl)-1-oxopropan-2-yl]-2-[(2-amino-1-oxo-3-phenylpropyl)-methylamino]-N,3-dimethylbutanamide IUPAC Name: N-[1-amino-3-(4-hydroxy-3-methylphenyl)-1-oxopropan-2-yl]-2-[(2-amino-3-phenylpropanoyl)-methylamino]-N,3-dimethylbutanamide Traditional Name: N-[2-amino-1-(4-hydroxy-3-methyl-benzyl)-2-keto-ethyl]-N,3-dimethyl-2-[methyl(phenylalanyl)amino]butyramide Formula: C26H36N4O4 MolecularWeight: 468.58844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC(C(=O)N)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC2=CC=CC=C2)N)O

Isomeric SMILES

CC1=C(C=CC(=C1)CC(C(=O)N)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC2=CC=CC=C2)N)O

InChI

InChI=1S/C26H36N4O4/c1-16(2)23(30(5)25(33)20(27)14-18-9-7-6-8-10-18)26(34)29(4)21(24(28)32)15-19-11-12-22(31)17(3)13-19/h6-13,16,20-21,23,31H,14-15,27H2,1-5H3,(H2,28,32)