7-chloranyl-3-[(2,6-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-3-[(2,6-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-[(2,6-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-3-[(2,6-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-3-[(2,6-dimethylphenyl)methyl]-5-(4-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-3-(2,6-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=C(C(=CC=C1)C)CC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=C(C=C4)F)C

Isomeric SMILES

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

InChI

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