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

Systemtic Name: 6-chloranyl-N-pyrimidin-5-yl-3-[[3-(trifluoromethyl)phenyl]amino]-1,2-benzoxazole-7-carboxamide Openeye Name: 6-chloro-N-pyrimidin-5-yl-3-[3-(trifluoromethyl)anilino]-1,2-benzoxazole-7-carboxamide CAS Name: 6-chloro-N-(5-pyrimidinyl)-3-[3-(trifluoromethyl)anilino]-1,2-benzoxazole-7-carboxamide IUPAC Name: 6-chloro-N-pyrimidin-5-yl-3-[3-(trifluoromethyl)anilino]-1,2-benzoxazole-7-carboxamide Traditional Name: 6-chloro-N-(5-pyrimidyl)-3-[3-(trifluoromethyl)anilino]indoxazene-7-carboxamide Formula: C19H11ClF3N5O2 MolecularWeight: 433.77115

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H11ClF3N5O2/c20-14-5-4-13-16(15(14)18(29)27-12-7-24-9-25-8-12)30-28-17(13)26-11-3-1-2-10(6-11)19(21,22)23/h1-9H,(H,26,28)(H,27,29)