3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one Openeye Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(2-thiazol-2-yl-1-piperidyl)propan-1-one CAS Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(2-thiazolyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one Traditional Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(2-thiazol-2-ylpiperidino)propan-1-one Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC=CS2)C(=O)CCN3CC(OC4=CC=CC=C4C3)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C(C1)C2=NC=CS2)C(=O)CCN3CC(OC4=CC=CC=C4C3)C5=CC=CC=C5

InChI

InChI=1S/C26H29N3O2S/c30-25(29-15-7-6-11-22(29)26-27-14-17-32-26)13-16-28-18-21-10-4-5-12-23(21)31-24(19-28)20-8-2-1-3-9-20/h1-5,8-10,12,14,17,22,24H,6-7,11,13,15-16,18-19H2