5-[(4-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)methyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(4-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)methyl]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[4-(2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]thiazolidine-2,4-dione CAS Name: 5-[[4-(2-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]thiazolidine-2,4-dione IUPAC Name: 5-[(4-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)methyl]-1,3-thiazolidine-2,4-dione Traditional Name: 5-[[4-(2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]thiazolidine-2,4-quinone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C3=CC=CC=N3)C=C(C=C2)CC4C(=O)NC(=O)S4

Isomeric SMILES

C1COC2=C(CN1C3=CC=CC=N3)C=C(C=C2)CC4C(=O)NC(=O)S4

InChI

InChI=1S/C18H17N3O3S/c22-17-15(25-18(23)20-17)10-12-4-5-14-13(9-12)11-21(7-8-24-14)16-3-1-2-6-19-16/h1-6,9,15H,7-8,10-11H2,(H,20,22,23)