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

Systemtic Name: 7-ethyl-2-(4-propan-2-ylphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-ethyl-2-(4-isopropylphenyl)-5-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-ethyl-2-(4-propan-2-ylphenyl)-5-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-ethyl-2-(4-propan-2-ylphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-ethyl-2-p-cumenyl-5-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C24H24N4 MolecularWeight: 368.47416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N4/c1-4-17-7-12-22-21(14-17)23(20-6-5-13-25-15-20)27-28-24(26-22)19-10-8-18(9-11-19)16(2)3/h5-16,27H,4H2,1-3H3