4-chloranyl-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-5-pyridin-2-ylsulfanyl-pyridin-4-yl]oxy-benzoic acid

Systemtic Name: 4-chloranyl-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-5-pyridin-2-ylsulfanyl-pyridin-4-yl]oxy-benzoic acid Openeye Name: 4-chloro-3-[[2-[(4-methylthiazol-2-yl)amino]-5-(2-pyridylsulfanyl)-4-pyridyl]oxy]benzoic acid CAS Name: 4-chloro-3-[[2-[(4-methyl-2-thiazolyl)amino]-5-(2-pyridinylthio)-4-pyridinyl]oxy]benzoic acid IUPAC Name: 4-chloro-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-5-pyridin-2-ylsulfanylpyridin-4-yl]oxybenzoic acid Traditional Name: 4-chloro-3-[[2-[(4-methylthiazol-2-yl)amino]-5-(2-pyridylthio)-4-pyridyl]oxy]benzoic acid Formula: C21H15ClN4O3S2 MolecularWeight: 470.9518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC2=NC=C(C(=C2)OC3=C(C=CC(=C3)C(=O)O)Cl)SC4=CC=CC=N4

Isomeric SMILES

CC1=CSC(=N1)NC2=NC=C(C(=C2)OC3=C(C=CC(=C3)C(=O)O)Cl)SC4=CC=CC=N4

InChI

InChI=1S/C21H15ClN4O3S2/c1-12-11-30-21(25-12)26-18-9-16(17(10-24-18)31-19-4-2-3-7-23-19)29-15-8-13(20(27)28)5-6-14(15)22/h2-11H,1H3,(H,27,28)(H,24,25,26)