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

Systemtic Name: 3-ethyl-2-pentylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 3-ethyl-2-pentylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 3-ethyl-2-(pentylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 3-ethyl-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 2-(amylthio)-3-ethyl-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:

CCCCCSC1=NC2=C(C(=O)N1CC)C3(CCCCC3)CC4=CC=CC=C42

Isomeric SMILES

CCCCCSC1=NC2=C(C(=O)N1CC)C3(CCCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C24H32N2OS/c1-3-5-11-16-28-23-25-21-19-13-8-7-12-18(19)17-24(14-9-6-10-15-24)20(21)22(27)26(23)4-2/h7-8,12-13H,3-6,9-11,14-17H2,1-2H3