1-[(2S)-4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone

Systemtic Name: 1-[(2S)-4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Openeye Name: 1-[(2S)-4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone CAS Name: 1-[(2S)-4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone IUPAC Name: 1-[(2S)-4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Traditional Name: 1-[(2S)-4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Formula: C23H19BrN2O MolecularWeight: 419.31376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1[C@@H](CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H19BrN2O/c1-16(27)26-22-10-6-5-9-20(22)25-21(17-11-13-19(24)14-12-17)15-23(26)18-7-3-2-4-8-18/h2-14,23H,15H2,1H3/t23-/m0/s1