2-methyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]pentanoic acid

Systemtic Name: 2-methyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]pentanoic acid Openeye Name: 2-methyl-2-[(2-phenylthiazol-4-yl)methylamino]pentanoic acid CAS Name: 2-methyl-2-[(2-phenyl-4-thiazolyl)methylamino]pentanoic acid IUPAC Name: 2-methyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]pentanoic acid Traditional Name: 2-methyl-2-[(2-phenylthiazol-4-yl)methylamino]valeric acid Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NCC1=CSC(=N1)C2=CC=CC=C2

Isomeric SMILES

CCCC(C)(C(=O)O)NCC1=CSC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O2S/c1-3-9-16(2,15(19)20)17-10-13-11-21-14(18-13)12-7-5-4-6-8-12/h4-8,11,17H,3,9-10H2,1-2H3,(H,19,20)