7-chloranyl-4-methyl-2-[[2,4,6-tris(bromanyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one

Systemtic Name: 7-chloranyl-4-methyl-2-[[2,4,6-tris(bromanyl)phenyl]methylamino]-3H-1,4-benzodiazepin-5-one Openeye Name: 7-chloro-4-methyl-2-[(2,4,6-tribromophenyl)methylamino]-3H-1,4-benzodiazepin-5-one CAS Name: 7-chloro-4-methyl-2-[(2,4,6-tribromophenyl)methylamino]-3H-1,4-benzodiazepin-5-one IUPAC Name: 7-chloro-4-methyl-2-[(2,4,6-tribromophenyl)methylamino]-3H-1,4-benzodiazepin-5-one Traditional Name: 7-chloro-4-methyl-2-[(2,4,6-tribromobenzyl)amino]-3H-1,4-benzodiazepin-5-one Formula: C17H13Br3ClN3O MolecularWeight: 550.46962

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=NC2=C(C1=O)C=C(C=C2)Cl)NCC3=C(C=C(C=C3Br)Br)Br

Isomeric SMILES

CN1CC(=NC2=C(C1=O)C=C(C=C2)Cl)NCC3=C(C=C(C=C3Br)Br)Br

InChI

InChI=1S/C17H13Br3ClN3O/c1-24-8-16(22-7-12-13(19)4-9(18)5-14(12)20)23-15-3-2-10(21)6-11(15)17(24)25/h2-6H,7-8H2,1H3,(H,22,23)