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

Systemtic Name: 1-(2,2-dimethyloxan-4-yl)-2-prop-2-enylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 2-allylsulfanyl-1-(2,2-dimethyltetrahydropyran-4-yl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 1-(2,2-dimethyl-4-oxanyl)-2-(prop-2-enylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 1-(2,2-dimethyloxan-4-yl)-2-prop-2-enylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 2-(allylthio)-1-(2,2-dimethyltetrahydropyran-4-yl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C27H34N2O2S MolecularWeight: 450.63606

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)N2C3=C(C(=O)N=C2SCC=C)C4(CCCCC4)CC5=CC=CC=C53)C

Isomeric SMILES

CC1(CC(CCO1)N2C3=C(C(=O)N=C2SCC=C)C4(CCCCC4)CC5=CC=CC=C53)C

InChI

InChI=1S/C27H34N2O2S/c1-4-16-32-25-28-24(30)22-23(29(25)20-12-15-31-26(2,3)18-20)21-11-7-6-10-19(21)17-27(22)13-8-5-9-14-27/h4,6-7,10-11,20H,1,5,8-9,12-18H2,2-3H3