3-[[4-(5-methyl-3-methylsulfanyl-1,2-oxazol-4-yl)pyridin-2-yl]amino]benzoic acid

Systemtic Name: 3-[[4-(5-methyl-3-methylsulfanyl-1,2-oxazol-4-yl)pyridin-2-yl]amino]benzoic acid Openeye Name: 3-[[4-(5-methyl-3-methylsulfanyl-isoxazol-4-yl)-2-pyridyl]amino]benzoic acid CAS Name: 3-[[4-[5-methyl-3-(methylthio)-4-isoxazolyl]-2-pyridinyl]amino]benzoic acid IUPAC Name: 3-[[4-(5-methyl-3-methylsulfanyl-1,2-oxazol-4-yl)pyridin-2-yl]amino]benzoic acid Traditional Name: 3-[[4-[5-methyl-3-(methylthio)isoxazol-4-yl]-2-pyridyl]amino]benzoic acid Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)SC)C2=CC(=NC=C2)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)SC)C2=CC(=NC=C2)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H15N3O3S/c1-10-15(16(24-2)20-23-10)11-6-7-18-14(9-11)19-13-5-3-4-12(8-13)17(21)22/h3-9H,1-2H3,(H,18,19)(H,21,22)