5-(4-chlorophenyl)-7-ethyl-2-pyridin-3-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 5-(4-chlorophenyl)-7-ethyl-2-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 5-(4-chlorophenyl)-7-ethyl-2-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 5-(4-chlorophenyl)-7-ethyl-2-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 5-(4-chlorophenyl)-7-ethyl-2-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 5-(4-chlorophenyl)-7-ethyl-2-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C21H17ClN4 MolecularWeight: 360.83948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CN=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CN=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN4/c1-2-14-5-10-19-18(12-14)20(15-6-8-17(22)9-7-15)25-26-21(24-19)16-4-3-11-23-13-16/h3-13,25H,2H2,1H3