5-[2,6-bis(fluoranyl)phenyl]-7-chloranyl-3-methyl-1,3-dihydro-1,4-benzodiazepine-2-thione

Systemtic Name: 5-[2,6-bis(fluoranyl)phenyl]-7-chloranyl-3-methyl-1,3-dihydro-1,4-benzodiazepine-2-thione Openeye Name: 7-chloro-5-(2,6-difluorophenyl)-3-methyl-1,3-dihydro-1,4-benzodiazepine-2-thione CAS Name: 7-chloro-5-(2,6-difluorophenyl)-3-methyl-1,3-dihydro-1,4-benzodiazepine-2-thione IUPAC Name: 7-chloro-5-(2,6-difluorophenyl)-3-methyl-1,3-dihydro-1,4-benzodiazepine-2-thione Traditional Name: 7-chloro-5-(2,6-difluorophenyl)-3-methyl-1,3-dihydro-1,4-benzodiazepine-2-thione Formula: C16H11ClF2N2S MolecularWeight: 336.786746

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)NC2=C(C=C(C=C2)Cl)C(=N1)C3=C(C=CC=C3F)F

Isomeric SMILES

CC1C(=S)NC2=C(C=C(C=C2)Cl)C(=N1)C3=C(C=CC=C3F)F

InChI

InChI=1S/C16H11ClF2N2S/c1-8-16(22)21-13-6-5-9(17)7-10(13)15(20-8)14-11(18)3-2-4-12(14)19/h2-8H,1H3,(H,21,22)