[[7-bromanyl-5-(2-bromophenyl)-3H-1,4-benzodiazepin-2-yl]amino] N-(2,6-dimethylphenyl)carbamate

Systemtic Name: [[7-bromanyl-5-(2-bromophenyl)-3H-1,4-benzodiazepin-2-yl]amino] N-(2,6-dimethylphenyl)carbamate Openeye Name: [[7-bromo-5-(2-bromophenyl)-3H-1,4-benzodiazepin-2-yl]amino] N-(2,6-dimethylphenyl)carbamate CAS Name: N-(2,6-dimethylphenyl)carbamic acid [[7-bromo-5-(2-bromophenyl)-3H-1,4-benzodiazepin-2-yl]amino] ester IUPAC Name: [[7-bromo-5-(2-bromophenyl)-3H-1,4-benzodiazepin-2-yl]amino] N-(2,6-dimethylphenyl)carbamate Traditional Name: N-(2,6-dimethylphenyl)carbamic acid [[7-bromo-5-(2-bromophenyl)-3H-1,4-benzodiazepin-2-yl]amino] ester Formula: C24H20Br2N4O2 MolecularWeight: 556.2492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)ONC2=NC3=C(C=C(C=C3)Br)C(=NC2)C4=CC=CC=C4Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)ONC2=NC3=C(C=C(C=C3)Br)C(=NC2)C4=CC=CC=C4Br

InChI

InChI=1S/C24H20Br2N4O2/c1-14-6-5-7-15(2)22(14)29-24(31)32-30-21-13-27-23(17-8-3-4-9-19(17)26)18-12-16(25)10-11-20(18)28-21/h3-12H,13H2,1-2H3,(H,28,30)(H,29,31)