3-azanyl-1-[(5-ethanoylfuran-2-yl)methyl]-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-1-[(5-ethanoylfuran-2-yl)methyl]-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 1-[(5-acetyl-2-furyl)methyl]-3-amino-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one CAS Name: 1-[(5-acetyl-2-furanyl)methyl]-3-amino-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-[(5-acetylfuran-2-yl)methyl]-3-amino-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 1-[(5-acetyl-2-furyl)methyl]-3-amino-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one Formula: C22H18FN3O3 MolecularWeight: 391.395023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(O1)CN2C3=CC=CC=C3C(=NC(C2=O)N)C4=CC=CC=C4F

Isomeric SMILES

CC(=O)C1=CC=C(O1)CN2C3=CC=CC=C3C(=NC(C2=O)N)C4=CC=CC=C4F

InChI

InChI=1S/C22H18FN3O3/c1-13(27)19-11-10-14(29-19)12-26-18-9-5-3-7-16(18)20(25-21(24)22(26)28)15-6-2-4-8-17(15)23/h2-11,21H,12,24H2,1H3