2-(3-chlorophenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 2-(3-chlorophenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine Openeye Name: 2-(3-chlorophenyl)-8-isopropyl-4-(4-pyridyl)-1H-1,3,5-benzotriazepine CAS Name: 2-(3-chlorophenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine IUPAC Name: 2-(3-chlorophenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine Traditional Name: 2-(3-chlorophenyl)-8-isopropyl-4-(4-pyridyl)-1H-1,3,5-benzotriazepine Formula: C22H19ClN4 MolecularWeight: 374.86606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(N=C(N2)C3=CC(=CC=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(N=C(N2)C3=CC(=CC=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C22H19ClN4/c1-14(2)16-6-7-19-20(13-16)26-22(17-4-3-5-18(23)12-17)27-21(25-19)15-8-10-24-11-9-15/h3-14H,1-2H3,(H,25,26,27)