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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(=NC2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H20FN3OS/c25-19-12-10-18(11-13-19)22-14-24(28-21-9-5-4-8-20(21)27-22)30-16-23(29)26-15-17-6-2-1-3-7-17/h1-13H,14-16H2,(H,26,29)