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

Systemtic Name: 7-chloranyl-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-2-(p-tolyl)-5-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-2-(p-tolyl)-5-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C20H15ClN4 MolecularWeight: 346.8129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)Cl)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)Cl)C4=CC=NC=C4

InChI

InChI=1S/C20H15ClN4/c1-13-2-4-15(5-3-13)20-23-18-7-6-16(21)12-17(18)19(24-25-20)14-8-10-22-11-9-14/h2-12,24H,1H3