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

Systemtic Name: 7-chloranyl-3-[(3,5-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-[(3,5-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-3-[(3,5-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-3-[(3,5-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-3-(3,5-dimethylbenzyl)-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Formula: C25H22ClFN2O MolecularWeight: 420.906383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=C(C=C4)F)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=C(C=C4)F)C)C

InChI

InChI=1S/C25H22ClFN2O/c1-15-10-16(2)12-17(11-15)13-22-25(30)29(3)23-9-6-19(26)14-21(23)24(28-22)18-4-7-20(27)8-5-18/h4-12,14,22H,13H2,1-3H3