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

Systemtic Name: [(7-bromanyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate Openeye Name: [(7-bromo-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate CAS Name: N-(2,6-dimethylphenyl)carbamic acid [(7-bromo-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester IUPAC Name: [(7-bromo-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate Traditional Name: N-(2,6-dimethylphenyl)carbamic acid [(7-bromo-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester Formula: C24H21BrN4O2 MolecularWeight: 477.35314

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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=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H21BrN4O2/c1-15-7-6-8-16(2)22(15)28-24(30)31-29-21-14-26-23(17-9-4-3-5-10-17)19-13-18(25)11-12-20(19)27-21/h3-13H,14H2,1-2H3,(H,27,29)(H,28,30)