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

Systemtic Name: 3-(cyclohexylmethyl)-2-methylsulfanyl-spiro[5H-benzo[h]quinazoline-6,1'-cyclohexane]-4-one Openeye Name: 3-(cyclohexylmethyl)-2-methylsulfanyl-spiro[5H-benzo[h]quinazoline-6,1'-cyclohexane]-4-one CAS Name: 3-(cyclohexylmethyl)-2-(methylthio)-4-spiro[5H-benzo[h]quinazoline-6,1'-cyclohexane]one IUPAC Name: 3-(cyclohexylmethyl)-2-methylsulfanylspiro[5H-benzo[h]quinazoline-6,1'-cyclohexane]-4-one Traditional Name: 3-(cyclohexylmethyl)-2-(methylthio)spiro[5H-benzo[h]quinazoline-6,1'-cyclohexane]-4-one Formula: C25H32N2OS MolecularWeight: 408.59938

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(CC3(CCCCC3)C4=CC=CC=C42)C(=O)N1CC5CCCCC5

Isomeric SMILES

CSC1=NC2=C(CC3(CCCCC3)C4=CC=CC=C42)C(=O)N1CC5CCCCC5

InChI

InChI=1S/C25H32N2OS/c1-29-24-26-22-19-12-6-7-13-21(19)25(14-8-3-9-15-25)16-20(22)23(28)27(24)17-18-10-4-2-5-11-18/h6-7,12-13,18H,2-5,8-11,14-17H2,1H3