2-[[4-[[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-methyl-amino]methyl]phenyl]carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-[[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-methyl-amino]methyl]phenyl]carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-[[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-methyl-amino]methyl]benzoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[[4-[[[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-methylamino]methyl]phenyl]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[4-[[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-methylamino]methyl]benzoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[4-[[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-methyl-amino]methyl]benzoyl]amino]-3-methyl-butyric acid Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)CN(C)C2=NC(=CS2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)CN(C)C2=NC(=CS2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C25H29N3O5S/c1-15(2)22(24(30)31)27-23(29)17-8-6-16(7-9-17)13-28(3)25-26-20(14-34-25)19-12-18(32-4)10-11-21(19)33-5/h6-12,14-15,22H,13H2,1-5H3,(H,27,29)(H,30,31)