5-(2-chlorophenyl)-3-methyl-7-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepine-2-thione

Systemtic Name: 5-(2-chlorophenyl)-3-methyl-7-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Openeye Name: 5-(2-chlorophenyl)-3-methyl-7-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepine-2-thione CAS Name: 5-(2-chlorophenyl)-3-methyl-7-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepine-2-thione IUPAC Name: 5-(2-chlorophenyl)-3-methyl-7-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Traditional Name: 5-(2-chlorophenyl)-3-methyl-7-(trifluoromethyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Formula: C17H12ClF3N2S MolecularWeight: 368.80379

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)NC2=C(C=C(C=C2)C(F)(F)F)C(=N1)C3=CC=CC=C3Cl

Isomeric SMILES

CC1C(=S)NC2=C(C=C(C=C2)C(F)(F)F)C(=N1)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H12ClF3N2S/c1-9-16(24)23-14-7-6-10(17(19,20)21)8-12(14)15(22-9)11-4-2-3-5-13(11)18/h2-9H,1H3,(H,23,24)