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

Systemtic Name: 2-(4-ethylphenyl)-7-propan-2-yl-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-ethylphenyl)-7-isopropyl-5-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 2-(4-ethylphenyl)-7-propan-2-yl-5-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-ethylphenyl)-7-propan-2-yl-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-ethylphenyl)-7-isopropyl-5-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C24H24N4 MolecularWeight: 368.47416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C(C)C)C4=CC=NC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C(C)C)C4=CC=NC=C4

InChI

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