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

Systemtic Name: (2,5-dimethylpyrazol-3-yl)-[7-pyridin-3-yl-9-(2-thiophen-2-ylethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Openeye Name: (2,5-dimethylpyrazol-3-yl)-[7-(3-pyridyl)-9-[2-(2-thienyl)ethoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone CAS Name: (2,5-dimethyl-3-pyrazolyl)-[7-(3-pyridinyl)-9-(2-thiophen-2-ylethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone IUPAC Name: (2,5-dimethylpyrazol-3-yl)-[7-pyridin-3-yl-9-(2-thiophen-2-ylethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Traditional Name: (2,5-dimethylpyrazol-3-yl)-[7-(3-pyridyl)-9-[2-(2-thienyl)ethoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3OCCC4=CC=CS4)C5=CN=CC=C5)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3OCCC4=CC=CS4)C5=CN=CC=C5)C

InChI

InChI=1S/C26H26N4O3S/c1-18-13-23(29(2)28-18)26(31)30-9-11-33-25-21(17-30)14-20(19-5-3-8-27-16-19)15-24(25)32-10-7-22-6-4-12-34-22/h3-6,8,12-16H,7,9-11,17H2,1-2H3