AC1MD3YS
3-methyl-N-[2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioylamino]ethyl]benzamide
Also Known As: F0095-1183|3-methyl-N-(2,2,2-trichloro-1-{[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]amino}ethyl)benzamide|3-methyl-N-(2,2,2-trichloro-1-(3-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)thioureido)ethyl)benzamide|3-methyl-N-[2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioylamino]ethyl]benzamide|3-methyl-N-[2,2,2-trichloro-1-({[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]carbothioyl}amino)ethyl]benzamide|N-{2,2,2-trichloro-1-[3-(3-cyano-1-thia-4,5,6,7-tetrahydro-2-indenyl)thioureido]ethyl}-m-toluamide
| Molecular Formula | C20H19Cl3N4OS2 |
|---|---|
| Molecular Weight | 500.0066 g/mol |
| LogP | 5.2197 |
| Topological Polar Surface Area | 76.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 500.0066 |
| Monoisotopic Mass | 500.0066 |
| Heavy Atoms | 30 |
| Complexity | 1010.4561 |
Chemical Identifiers
| CAS Number | 324017-89-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=C(C3=C(S2)CCCC3)C#N |
Product Overview
AC1MD3YS (CAS 324017-89-2), with molecular formula C20H19Cl3N4OS2 and molecular weight 500.0066 g/mol. IUPAC: 3-methyl-N-[2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioylamino]ethyl]benzamide.