4-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylamino]butanoic acid

Systemtic Name: 4-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylamino]butanoic acid Openeye Name: 4-[[2-(p-tolyl)thiazol-4-yl]methylamino]butanoic acid CAS Name: 4-[[2-(4-methylphenyl)-4-thiazolyl]methylamino]butanoic acid IUPAC Name: 4-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylamino]butanoic acid Traditional Name: 4-[[2-(p-tolyl)thiazol-4-yl]methylamino]butyric acid Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CNCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CNCCCC(=O)O

InChI

InChI=1S/C15H18N2O2S/c1-11-4-6-12(7-5-11)15-17-13(10-20-15)9-16-8-2-3-14(18)19/h4-7,10,16H,2-3,8-9H2,1H3,(H,18,19)