7,8-bis(chloranyl)-4-[3-(2-propan-2-ylpyridin-4-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 7,8-bis(chloranyl)-4-[3-(2-propan-2-ylpyridin-4-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 7,8-dichloro-4-[3-(2-isopropyl-4-pyridyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 7,8-dichloro-4-[3-(2-propan-2-yl-4-pyridinyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 7,8-dichloro-4-[3-(2-propan-2-ylpyridin-4-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 7,8-dichloro-4-[3-(2-isopropyl-4-pyridyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C23H19Cl2N3O MolecularWeight: 424.32246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=CC(=C1)C2=CC(=CC=C2)C3=NC4=CC(=C(C=C4NC(=O)C3)Cl)Cl

Isomeric SMILES

CC(C)C1=NC=CC(=C1)C2=CC(=CC=C2)C3=NC4=CC(=C(C=C4NC(=O)C3)Cl)Cl

InChI

InChI=1S/C23H19Cl2N3O/c1-13(2)19-9-15(6-7-26-19)14-4-3-5-16(8-14)20-12-23(29)28-22-11-18(25)17(24)10-21(22)27-20/h3-11,13H,12H2,1-2H3,(H,28,29)