2-(4-bromophenyl)-7-methyl-5-phenyl-4H-1,3,4-benzotriazepine

Systemtic Name: 2-(4-bromophenyl)-7-methyl-5-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-bromophenyl)-7-methyl-5-phenyl-4H-1,3,4-benzotriazepine CAS Name: 2-(4-bromophenyl)-7-methyl-5-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-bromophenyl)-7-methyl-5-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-bromophenyl)-7-methyl-5-phenyl-4H-1,3,4-benzotriazepine Formula: C21H16BrN3 MolecularWeight: 390.27584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C21H16BrN3/c1-14-7-12-19-18(13-14)20(15-5-3-2-4-6-15)24-25-21(23-19)16-8-10-17(22)11-9-16/h2-13,24H,1H3