5-butyl-7-chloranyl-4-phenyl-5-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 5-butyl-7-chloranyl-4-phenyl-5-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 5-butyl-7-chloro-4-phenyl-5-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 5-butyl-7-chloro-4-phenyl-5-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 5-butyl-7-chloro-4-phenyl-5-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 5-butyl-7-chloro-4-phenyl-5-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C20H20ClF3N2O MolecularWeight: 396.83381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(C=CC(=C2)Cl)NC(=O)CN1C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCCCC1(C2=C(C=CC(=C2)Cl)NC(=O)CN1C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H20ClF3N2O/c1-2-3-11-19(20(22,23)24)16-12-14(21)9-10-17(16)25-18(27)13-26(19)15-7-5-4-6-8-15/h4-10,12H,2-3,11,13H2,1H3,(H,25,27)