2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]thio]-N-(m-tolyl)acetamide Formula: C24H20FN3OS MolecularWeight: 417.498503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C(C2)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C(C2)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H20FN3OS/c1-16-5-4-6-19(13-16)26-23(29)15-30-24-14-22(17-9-11-18(25)12-10-17)27-20-7-2-3-8-21(20)28-24/h2-13H,14-15H2,1H3,(H,26,29)