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

Systemtic Name: 7-chloranyl-5-(4-methylphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-5-(p-tolyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-5-(4-methylphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-5-(4-methylphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-5-(p-tolyl)-2-(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=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)Cl

Isomeric SMILES

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

InChI

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