[7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-pyridin-3-yl-methanone

Systemtic Name: [7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-pyridin-3-yl-methanone Openeye Name: [7-(3-chlorophenyl)-9-(3-thienylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-pyridyl)methanone CAS Name: [7-(3-chlorophenyl)-9-(3-thiophenylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-pyridinyl)methanone IUPAC Name: [7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-pyridin-3-ylmethanone Traditional Name: [7-(3-chlorophenyl)-9-(3-thenyloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-pyridyl)methanone Formula: C26H21ClN2O3S MolecularWeight: 476.97454

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)C3=CN=CC=C3)C=C(C=C2OCC4=CSC=C4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1COC2=C(CN1C(=O)C3=CN=CC=C3)C=C(C=C2OCC4=CSC=C4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H21ClN2O3S/c27-23-5-1-3-19(12-23)21-11-22-15-29(26(30)20-4-2-7-28-14-20)8-9-31-25(22)24(13-21)32-16-18-6-10-33-17-18/h1-7,10-14,17H,8-9,15-16H2