7-chloranyl-4-methyl-2-[[4-(trifluoromethyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one

Systemtic Name: 7-chloranyl-4-methyl-2-[[4-(trifluoromethyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one Openeye Name: 7-chloro-4-methyl-2-[[4-(trifluoromethyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one CAS Name: 7-chloro-4-methyl-2-[[4-(trifluoromethyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one IUPAC Name: 7-chloro-4-methyl-2-[[4-(trifluoromethyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one Traditional Name: 7-chloro-4-methyl-2-[[4-(trifluoromethyl)benzyl]amino]-3H-1,4-benzodiazepin-5-one Formula: C18H15ClF3N3O MolecularWeight: 381.77941

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=NC2=C(C1=O)C=C(C=C2)Cl)NCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN1CC(=NC2=C(C1=O)C=C(C=C2)Cl)NCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H15ClF3N3O/c1-25-10-16(24-15-7-6-13(19)8-14(15)17(25)26)23-9-11-2-4-12(5-3-11)18(20,21)22/h2-8H,9-10H2,1H3,(H,23,24)