3-(2,2-dimethyloxan-4-yl)-2-hexylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-2-hexylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-2-hexylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 3-(2,2-dimethyl-4-oxanyl)-2-(hexylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 3-(2,2-dimethyloxan-4-yl)-2-hexylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 3-(2,2-dimethyltetrahydropyran-4-yl)-2-(hexylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C30H42N2O2S MolecularWeight: 494.73168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(C(=O)N1C3CCOC(C3)(C)C)C4(CCCCC4)CC5=CC=CC=C52

Isomeric SMILES

CCCCCCSC1=NC2=C(C(=O)N1C3CCOC(C3)(C)C)C4(CCCCC4)CC5=CC=CC=C52

InChI

InChI=1S/C30H42N2O2S/c1-4-5-6-12-19-35-28-31-26-24-14-9-8-13-22(24)20-30(16-10-7-11-17-30)25(26)27(33)32(28)23-15-18-34-29(2,3)21-23/h8-9,13-14,23H,4-7,10-12,15-21H2,1-3H3