6-chloranyl-N-pyrimidin-5-yl-3-[[3-(trifluoromethyloxy)phenyl]amino]-1,2-benzoxazole-7-carboxamide

Systemtic Name: 6-chloranyl-N-pyrimidin-5-yl-3-[[3-(trifluoromethyloxy)phenyl]amino]-1,2-benzoxazole-7-carboxamide Openeye Name: 6-chloro-N-pyrimidin-5-yl-3-[3-(trifluoromethoxy)anilino]-1,2-benzoxazole-7-carboxamide CAS Name: 6-chloro-N-(5-pyrimidinyl)-3-[3-(trifluoromethoxy)anilino]-1,2-benzoxazole-7-carboxamide IUPAC Name: 6-chloro-N-pyrimidin-5-yl-3-[3-(trifluoromethoxy)anilino]-1,2-benzoxazole-7-carboxamide Traditional Name: 6-chloro-N-(5-pyrimidyl)-3-[3-(trifluoromethoxy)anilino]indoxazene-7-carboxamide Formula: C19H11ClF3N5O3 MolecularWeight: 449.77055

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)NC2=NOC3=C2C=CC(=C3C(=O)NC4=CN=CN=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)NC2=NOC3=C2C=CC(=C3C(=O)NC4=CN=CN=C4)Cl

InChI

InChI=1S/C19H11ClF3N5O3/c20-14-5-4-13-16(15(14)18(29)27-11-7-24-9-25-8-11)31-28-17(13)26-10-2-1-3-12(6-10)30-19(21,22)23/h1-9H,(H,26,28)(H,27,29)