3-(2,2-dimethyloxan-4-yl)-1-propan-2-ylsulfanyl-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-1-propan-2-ylsulfanyl-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one Openeye Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-1-isopropylsulfanyl-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one CAS Name: 3-(2,2-dimethyl-4-oxanyl)-1-(propan-2-ylthio)-4-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]one IUPAC Name: 3-(2,2-dimethyloxan-4-yl)-1-propan-2-ylsulfanylspiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one Traditional Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-1-(isopropylthio)spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one Formula: C26H34N2O2S MolecularWeight: 438.62536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN(C(=O)C2=C1C3=CC=CC=C3CC24CCCC4)C5CCOC(C5)(C)C

Isomeric SMILES

CC(C)SC1=NN(C(=O)C2=C1C3=CC=CC=C3CC24CCCC4)C5CCOC(C5)(C)C

InChI

InChI=1S/C26H34N2O2S/c1-17(2)31-23-21-20-10-6-5-9-18(20)15-26(12-7-8-13-26)22(21)24(29)28(27-23)19-11-14-30-25(3,4)16-19/h5-6,9-10,17,19H,7-8,11-16H2,1-4H3