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

Systemtic Name: 1-ethyl-2-(3-methylbutylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 1-ethyl-2-isopentylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 1-ethyl-2-(3-methylbutylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 1-ethyl-2-(3-methylbutylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 1-ethyl-2-(isoamylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C24H32N2OS MolecularWeight: 396.58868

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=C1SCCC(C)C)C3(CCCCC3)CC4=CC=CC=C42

Isomeric SMILES

CCN1C2=C(C(=O)N=C1SCCC(C)C)C3(CCCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C24H32N2OS/c1-4-26-21-19-11-7-6-10-18(19)16-24(13-8-5-9-14-24)20(21)22(27)25-23(26)28-15-12-17(2)3/h6-7,10-11,17H,4-5,8-9,12-16H2,1-3H3