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

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-1-ethylsulfanyl-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one Openeye Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-1-ethylsulfanyl-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one CAS Name: 3-(2,2-dimethyl-4-oxanyl)-1-(ethylthio)-4-spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]one IUPAC Name: 3-(2,2-dimethyloxan-4-yl)-1-ethylsulfanylspiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one Traditional Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-1-(ethylthio)spiro[6H-benzo[f]phthalazine-5,1'-cyclopentane]-4-one Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN(C(=O)C2=C1C3=CC=CC=C3CC24CCCC4)C5CCOC(C5)(C)C

Isomeric SMILES

CCSC1=NN(C(=O)C2=C1C3=CC=CC=C3CC24CCCC4)C5CCOC(C5)(C)C

InChI

InChI=1S/C25H32N2O2S/c1-4-30-22-20-19-10-6-5-9-17(19)15-25(12-7-8-13-25)21(20)23(28)27(26-22)18-11-14-29-24(2,3)16-18/h5-6,9-10,18H,4,7-8,11-16H2,1-3H3