4-[(4-bromanylthiophen-2-yl)methyl]-7-chloranyl-5-(trifluoromethyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-[(4-bromanylthiophen-2-yl)methyl]-7-chloranyl-5-(trifluoromethyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-[(4-bromo-2-thienyl)methyl]-7-chloro-5-(trifluoromethyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[(4-bromo-2-thiophenyl)methyl]-7-chloro-5-(trifluoromethyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-[(4-bromothiophen-2-yl)methyl]-7-chloro-5-(trifluoromethyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-[(4-bromo-2-thienyl)methyl]-7-chloro-5-(trifluoromethyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C15H11BrClF3N2OS MolecularWeight: 439.67785

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Cl)C(N1CC3=CC(=CS3)Br)C(F)(F)F

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Cl)C(N1CC3=CC(=CS3)Br)C(F)(F)F

InChI

InChI=1S/C15H11BrClF3N2OS/c16-8-3-10(24-7-8)5-22-6-13(23)21-12-2-1-9(17)4-11(12)14(22)15(18,19)20/h1-4,7,14H,5-6H2,(H,21,23)