3-(chloromethyl)-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 3-(chloromethyl)-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 3-(chloromethyl)-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1,4-benzoxazepin-5-one CAS Name: 3-(chloromethyl)-4-[4-[4-(2-pyrimidinyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 3-(chloromethyl)-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 3-(chloromethyl)-4-[4-[4-(2-pyrimidyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-1,4-benzoxazepin-5-one Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=NC=CC=N2)CCCCN3C(=COC4=CC=CC=C4C3=O)CCl

Isomeric SMILES

C1CN(CC=C1C2=NC=CC=N2)CCCCN3C(=COC4=CC=CC=C4C3=O)CCl

InChI

InChI=1S/C23H25ClN4O2/c24-16-19-17-30-21-7-2-1-6-20(21)23(29)28(19)13-4-3-12-27-14-8-18(9-15-27)22-25-10-5-11-26-22/h1-2,5-8,10-11,17H,3-4,9,12-16H2