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

Systemtic Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[[2-(4-fluorophenyl)-3H-1,5-benzodiazepin-4-yl]thio]-N-(3-methoxyphenyl)acetamide Formula: C24H20FN3O2S MolecularWeight: 433.497903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C(C2)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C(C2)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H20FN3O2S/c1-30-19-6-4-5-18(13-19)26-23(29)15-31-24-14-22(16-9-11-17(25)12-10-16)27-20-7-2-3-8-21(20)28-24/h2-13H,14-15H2,1H3,(H,26,29)