AC1OBMJ8
1-ethyl-3-[(E)-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]methylideneamino]thiourea
Also Known As: (2E)-N-ethyl-2-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]benzylidene}hydrazinecarbothioamide|(E)-N-ethyl-2-(4-methoxy-3-((3-methyl-4-nitrophenoxy)methyl)benzylidene)hydrazinecarbothioamide|[((1E)-2-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}-1-azavinyl)amin o](ethylamino)methane-1-thione|1-ethyl-3-[(E)-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]methylideneamino]thiourea
| Molecular Formula | C19H22N4O4S |
|---|---|
| Molecular Weight | 402.13617 g/mol |
| LogP | 3.30872 |
| Topological Polar Surface Area | 98.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 402.13617 |
| Monoisotopic Mass | 402.13617 |
| Heavy Atoms | 28 |
| Complexity | 886.2325 |
Chemical Identifiers
| CAS Number | 528561-39-9 |
|---|---|
| SMILES | CCNC(=S)N/N=C/C1=CC(=C(C=C1)OC)COC2=CC(=C(C=C2)[N+](=O)[O-])C |
Product Overview
AC1OBMJ8 (CAS 528561-39-9), with molecular formula C19H22N4O4S and molecular weight 402.13617 g/mol. IUPAC: 1-ethyl-3-[(E)-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]methylideneamino]thiourea.
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