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

Systemtic Name: N-[1-azanyl-3-[3-(2-methylpropanoyl)-4-oxidanyl-phenyl]-1-oxidanylidene-propan-2-yl]-2-[(2-azanyl-3-phenyl-propanoyl)-methyl-amino]-3-methyl-butanamide Openeye Name: N-[2-amino-1-[[4-hydroxy-3-(2-methylpropanoyl)phenyl]methyl]-2-oxo-ethyl]-2-[(2-amino-3-phenyl-propanoyl)-methyl-amino]-3-methyl-butanamide CAS Name: N-[1-amino-3-[4-hydroxy-3-(2-methyl-1-oxopropyl)phenyl]-1-oxopropan-2-yl]-2-[(2-amino-1-oxo-3-phenylpropyl)-methylamino]-3-methylbutanamide IUPAC Name: N-[1-amino-3-[4-hydroxy-3-(2-methylpropanoyl)phenyl]-1-oxopropan-2-yl]-2-[(2-amino-3-phenylpropanoyl)-methylamino]-3-methylbutanamide Traditional Name: N-[2-amino-1-(4-hydroxy-3-isobutyryl-benzyl)-2-keto-ethyl]-3-methyl-2-[methyl(phenylalanyl)amino]butyramide Formula: C28H38N4O5 MolecularWeight: 510.62512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N4O5/c1-16(2)24(32(5)28(37)21(29)14-18-9-7-6-8-10-18)27(36)31-22(26(30)35)15-19-11-12-23(33)20(13-19)25(34)17(3)4/h6-13,16-17,21-22,24,33H,14-15,29H2,1-5H3,(H2,30,35)(H,31,36)