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

Systemtic Name: 4-methyl-2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-phenethyl-amino]methyl]phenyl]carbonylamino]pentanoic acid Openeye Name: 4-methyl-2-[[4-[[(5-methyl-4-phenyl-thiazol-2-yl)-phenethyl-amino]methyl]benzoyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[[4-[[(5-methyl-4-phenyl-2-thiazolyl)-phenethylamino]methyl]phenyl]-oxomethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-phenethylamino]methyl]benzoyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[4-[[(5-methyl-4-phenyl-thiazol-2-yl)-phenethyl-amino]methyl]benzoyl]amino]valeric acid Formula: C32H35N3O3S MolecularWeight: 541.7036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC(CC(C)C)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC(CC(C)C)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C32H35N3O3S/c1-22(2)20-28(31(37)38)33-30(36)27-16-14-25(15-17-27)21-35(19-18-24-10-6-4-7-11-24)32-34-29(23(3)39-32)26-12-8-5-9-13-26/h4-17,22,28H,18-21H2,1-3H3,(H,33,36)(H,37,38)