4-azanyl-3-[[2-[1-azanyl-2-(4-phenylmethoxyphenyl)ethyl]-1,3-thiazol-4-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-3-[[2-[1-azanyl-2-(4-phenylmethoxyphenyl)ethyl]-1,3-thiazol-4-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-3-[[2-[1-amino-2-(4-benzyloxyphenyl)ethyl]thiazole-4-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-3-[[[2-[1-amino-2-(4-phenylmethoxyphenyl)ethyl]-4-thiazolyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-3-[[2-[1-amino-2-(4-phenylmethoxyphenyl)ethyl]-1,3-thiazole-4-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-3-[[2-[1-amino-2-(4-benzoxyphenyl)ethyl]thiazole-4-carbonyl]amino]-4-keto-butyric acid Formula: C23H24N4O5S MolecularWeight: 468.52546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C3=NC(=CS3)C(=O)NC(CC(=O)O)C(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C3=NC(=CS3)C(=O)NC(CC(=O)O)C(=O)N)N

InChI

InChI=1S/C23H24N4O5S/c24-17(10-14-6-8-16(9-7-14)32-12-15-4-2-1-3-5-15)23-27-19(13-33-23)22(31)26-18(21(25)30)11-20(28)29/h1-9,13,17-18H,10-12,24H2,(H2,25,30)(H,26,31)(H,28,29)