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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCCC(C)C

Isomeric SMILES

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCCC(C)C

InChI

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