7-chloranyl-5-(4-fluorophenyl)-1-methyl-3-[(2-methylphenyl)methyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(4-fluorophenyl)-1-methyl-3-[(2-methylphenyl)methyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-(4-fluorophenyl)-1-methyl-3-(o-tolylmethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(4-fluorophenyl)-1-methyl-3-[(2-methylphenyl)methyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(4-fluorophenyl)-1-methyl-3-[(2-methylphenyl)methyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-(4-fluorophenyl)-1-methyl-3-(2-methylbenzyl)-3H-1,4-benzodiazepin-2-one Formula: C24H20ClFN2O MolecularWeight: 406.879803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC=CC=C1CC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C24H20ClFN2O/c1-15-5-3-4-6-17(15)13-21-24(29)28(2)22-12-9-18(25)14-20(22)23(27-21)16-7-10-19(26)11-8-16/h3-12,14,21H,13H2,1-2H3