CBMicro_038098
12-ethyl-16-sulfanylidenespiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13-pentaene-9,1'-cyclohexane]-11-one
Also Known As: CBMicro_038098|Oprea1_084171|Oprea1_729626|BAS 01312904|BIM-0038223.P001|4-ethyl-1-mercapto-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one|4-ethyl-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one|4-ethyl-1-sulfanylspiro[4,6,7,12-tetrahydrobenzo[h]1,2,4-triazolo[4,3-a]quinaz oline-6,1'-cyclohexane]-5-one
| Molecular Formula | C20H22N4OS |
|---|---|
| Molecular Weight | 366.15143 g/mol |
| LogP | 3.99849 |
| Topological Polar Surface Area | 55.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 366.15143 |
| Monoisotopic Mass | 366.15143 |
| Heavy Atoms | 26 |
| Complexity | 1130.8992 |
Chemical Identifiers
| CAS Number | 337488-01-4 |
|---|---|
| SMILES | CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N5C1=NNC5=S |
Product Overview
CBMicro_038098 (CAS 337488-01-4), with molecular formula C20H22N4OS and molecular weight 366.15143 g/mol. IUPAC: 12-ethyl-16-sulfanylidenespiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13-pentaene-9,1'-cyclohexane]-11-one.
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