7-(4-chloranyl-3-pyridin-4-yl-pyrazol-1-yl)-1-propan-2-yl-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: 7-(4-chloranyl-3-pyridin-4-yl-pyrazol-1-yl)-1-propan-2-yl-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 7-[4-chloro-3-(4-pyridyl)pyrazol-1-yl]-1-isopropyl-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 7-(4-chloro-3-pyridin-4-yl-1-pyrazolyl)-1-propan-2-yl-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 7-(4-chloro-3-pyridin-4-ylpyrazol-1-yl)-1-propan-2-yl-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 7-[4-chloro-3-(4-pyridyl)pyrazol-1-yl]-1-isopropyl-4,5-dihydro-3H-1-benzazepin-2-one Formula: C21H21ClN4O MolecularWeight: 380.87064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)CCCC2=C1C=CC(=C2)N3C=C(C(=N3)C4=CC=NC=C4)Cl

Isomeric SMILES

CC(C)N1C(=O)CCCC2=C1C=CC(=C2)N3C=C(C(=N3)C4=CC=NC=C4)Cl

InChI

InChI=1S/C21H21ClN4O/c1-14(2)26-19-7-6-17(12-16(19)4-3-5-20(26)27)25-13-18(22)21(24-25)15-8-10-23-11-9-15/h6-14H,3-5H2,1-2H3