7-chloranyl-5-(4-methylphenyl)-2-phenyl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-chloranyl-5-(4-methylphenyl)-2-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-2-phenyl-5-(p-tolyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-5-(4-methylphenyl)-2-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-5-(4-methylphenyl)-2-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-2-phenyl-5-(p-tolyl)-4H-1,3,4-benzotriazepine Formula: C21H16ClN3 MolecularWeight: 345.82484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H16ClN3/c1-14-7-9-15(10-8-14)20-18-13-17(22)11-12-19(18)23-21(25-24-20)16-5-3-2-4-6-16/h2-13,24H,1H3