2-acetamido-N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-2-methylsulfanyl-ethanamide

Systemtic Name: 2-acetamido-N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-2-methylsulfanyl-ethanamide Openeye Name: 2-acetamido-N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-2-methylsulfanyl-acetamide CAS Name: 2-acetamido-N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-2-(methylthio)acetamide IUPAC Name: 2-acetamido-N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-2-methylsulfanylacetamide Traditional Name: 2-acetamido-N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-2-(methylthio)acetamide Formula: C22H25FN4O2S MolecularWeight: 428.522903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)NCC1CN=C(C2=CC=CC=C2N1C)C3=CC=CC=C3F)SC

Isomeric SMILES

CC(=O)NC(C(=O)NCC1CN=C(C2=CC=CC=C2N1C)C3=CC=CC=C3F)SC

InChI

InChI=1S/C22H25FN4O2S/c1-14(28)26-22(30-3)21(29)25-13-15-12-24-20(16-8-4-6-10-18(16)23)17-9-5-7-11-19(17)27(15)2/h4-11,15,22H,12-13H2,1-3H3,(H,25,29)(H,26,28)