methyl 2-[bis(2-azanyl-3-phenyl-propanoyl)amino]-3-(4H-imidazol-4-yl)propanoate

Systemtic Name: methyl 2-[bis(2-azanyl-3-phenyl-propanoyl)amino]-3-(4H-imidazol-4-yl)propanoate Openeye Name: methyl 2-[bis(2-amino-3-phenyl-propanoyl)amino]-3-(4H-imidazol-4-yl)propanoate CAS Name: 2-[bis(2-amino-1-oxo-3-phenylpropyl)amino]-3-(4H-imidazol-4-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[bis(2-amino-3-phenylpropanoyl)amino]-3-(4H-imidazol-4-yl)propanoate Traditional Name: 2-(diphenylalanylamino)-3-(4H-imidazol-4-yl)propionic acid methyl ester Formula: C25H29N5O4 MolecularWeight: 463.52886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1C=NC=N1)N(C(=O)C(CC2=CC=CC=C2)N)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

COC(=O)C(CC1C=NC=N1)N(C(=O)C(CC2=CC=CC=C2)N)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C25H29N5O4/c1-34-25(33)22(14-19-15-28-16-29-19)30(23(31)20(26)12-17-8-4-2-5-9-17)24(32)21(27)13-18-10-6-3-7-11-18/h2-11,15-16,19-22H,12-14,26-27H2,1H3