[7-chloranyl-5-oxidanyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-yl]cyanamide

Systemtic Name: [7-chloranyl-5-oxidanyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-yl]cyanamide Openeye Name: [7-chloro-5-hydroxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-yl]cyanamide CAS Name: [7-chloro-5-hydroxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-yl]cyanamide IUPAC Name: [7-chloro-5-hydroxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-yl]cyanamide Traditional Name: [7-chloro-5-hydroxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-yl]cyanamide Formula: C11H8ClF3N4O MolecularWeight: 304.65563

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)Cl)NC(=N1)NC#N)(C(F)(F)F)O

Isomeric SMILES

C1C(C2=C(C=CC(=C2)Cl)NC(=N1)NC#N)(C(F)(F)F)O

InChI

InChI=1S/C11H8ClF3N4O/c12-6-1-2-8-7(3-6)10(20,11(13,14)15)4-17-9(19-8)18-5-16/h1-3,20H,4H2,(H2,17,18,19)