5-(2-chlorophenyl)-7-fluoranyl-1-(1-methylpiperidin-4-yl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 5-(2-chlorophenyl)-7-fluoranyl-1-(1-methylpiperidin-4-yl)-3H-1,4-benzodiazepin-2-one Openeye Name: 5-(2-chlorophenyl)-7-fluoro-1-(1-methyl-4-piperidyl)-3H-1,4-benzodiazepin-2-one CAS Name: 5-(2-chlorophenyl)-7-fluoro-1-(1-methyl-4-piperidinyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(2-chlorophenyl)-7-fluoro-1-(1-methylpiperidin-4-yl)-3H-1,4-benzodiazepin-2-one Traditional Name: 5-(2-chlorophenyl)-7-fluoro-1-(1-methyl-4-piperidyl)-3H-1,4-benzodiazepin-2-one Formula: C21H21ClFN3O MolecularWeight: 385.862343

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2C(=O)CN=C(C3=C2C=CC(=C3)F)C4=CC=CC=C4Cl

Isomeric SMILES

CN1CCC(CC1)N2C(=O)CN=C(C3=C2C=CC(=C3)F)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H21ClFN3O/c1-25-10-8-15(9-11-25)26-19-7-6-14(23)12-17(19)21(24-13-20(26)27)16-4-2-3-5-18(16)22/h2-7,12,15H,8-11,13H2,1H3