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

Systemtic Name: 2,2-diphenyl-1-[7-pyridin-3-yl-9-(2-thiophen-2-ylethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Openeye Name: 2,2-diphenyl-1-[7-(3-pyridyl)-9-[2-(2-thienyl)ethoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone CAS Name: 2,2-diphenyl-1-[7-(3-pyridinyl)-9-(2-thiophen-2-ylethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone IUPAC Name: 2,2-diphenyl-1-[7-pyridin-3-yl-9-(2-thiophen-2-ylethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Traditional Name: 2,2-diphenyl-1-[7-(3-pyridyl)-9-[2-(2-thienyl)ethoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Formula: C34H30N2O3S MolecularWeight: 546.6786

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C=C(C=C2OCCC5=CC=CS5)C6=CN=CC=C6

Isomeric SMILES

C1COC2=C(CN1C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C=C(C=C2OCCC5=CC=CS5)C6=CN=CC=C6

InChI

InChI=1S/C34H30N2O3S/c37-34(32(25-9-3-1-4-10-25)26-11-5-2-6-12-26)36-17-19-39-33-29(24-36)21-28(27-13-7-16-35-23-27)22-31(33)38-18-15-30-14-8-20-40-30/h1-14,16,20-23,32H,15,17-19,24H2