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

Systemtic Name: 4-methyl-3-[(2-methyl-1,3-thiazol-4-yl)methylamino]benzoic acid Openeye Name: 4-methyl-3-[(2-methylthiazol-4-yl)methylamino]benzoic acid CAS Name: 4-methyl-3-[(2-methyl-4-thiazolyl)methylamino]benzoic acid IUPAC Name: 4-methyl-3-[(2-methyl-1,3-thiazol-4-yl)methylamino]benzoic acid Traditional Name: 4-methyl-3-[(2-methylthiazol-4-yl)methylamino]benzoic acid Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NCC2=CSC(=N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NCC2=CSC(=N2)C

InChI

InChI=1S/C13H14N2O2S/c1-8-3-4-10(13(16)17)5-12(8)14-6-11-7-18-9(2)15-11/h3-5,7,14H,6H2,1-2H3,(H,16,17)