2-[(4-pyridin-4-ylsulfanylphenyl)amino]-1,3-benzoxazole-6-carboxylic acid

Systemtic Name: 2-[(4-pyridin-4-ylsulfanylphenyl)amino]-1,3-benzoxazole-6-carboxylic acid Openeye Name: 2-[4-(4-pyridylsulfanyl)anilino]-1,3-benzoxazole-6-carboxylic acid CAS Name: 2-[4-(pyridin-4-ylthio)anilino]-1,3-benzoxazole-6-carboxylic acid IUPAC Name: 2-(4-pyridin-4-ylsulfanylanilino)-1,3-benzoxazole-6-carboxylic acid Traditional Name: 2-[4-(4-pyridylthio)anilino]-1,3-benzoxazole-6-carboxylic acid Formula: C19H13N3O3S MolecularWeight: 363.38982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC3=C(O2)C=C(C=C3)C(=O)O)SC4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC=C1NC2=NC3=C(O2)C=C(C=C3)C(=O)O)SC4=CC=NC=C4

InChI

InChI=1S/C19H13N3O3S/c23-18(24)12-1-6-16-17(11-12)25-19(22-16)21-13-2-4-14(5-3-13)26-15-7-9-20-10-8-15/h1-11H,(H,21,22)(H,23,24)