2-(4-bromophenyl)-7-chloranyl-9-methyl-5-phenyl-4H-1,3,4-benzotriazepine

Systemtic Name: 2-(4-bromophenyl)-7-chloranyl-9-methyl-5-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-bromophenyl)-7-chloro-9-methyl-5-phenyl-4H-1,3,4-benzotriazepine CAS Name: 2-(4-bromophenyl)-7-chloro-9-methyl-5-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-bromophenyl)-7-chloro-9-methyl-5-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-bromophenyl)-7-chloro-9-methyl-5-phenyl-4H-1,3,4-benzotriazepine Formula: C21H15BrClN3 MolecularWeight: 424.7209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C(NN=C(N=C12)C3=CC=C(C=C3)Br)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=CC2=C(NN=C(N=C12)C3=CC=C(C=C3)Br)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H15BrClN3/c1-13-11-17(23)12-18-19(13)24-21(15-7-9-16(22)10-8-15)26-25-20(18)14-5-3-2-4-6-14/h2-12,25H,1H3