7-chloranyl-1-(methylsulfonylmethyl)-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(methylsulfonylmethyl)-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(methylsulfonylmethyl)-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(methylsulfonylmethyl)-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(methylsulfonylmethyl)-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(mesylmethyl)-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Formula: C18H14ClF3N2O3S MolecularWeight: 430.82857

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CS(=O)(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H14ClF3N2O3S/c1-28(26,27)10-24-15-7-6-11(19)8-13(15)17(23-9-16(24)25)12-4-2-3-5-14(12)18(20,21)22/h2-8H,9-10H2,1H3