AC1LPZX5
N-[4-[5-[(2-chloro-6-nitrophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]acetamide
Also Known As: SR-01000264481-1|N-(4-{5-[(2-chloro-6-nitrobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}phenyl)acetamide|N-[4-[5-[(2-chloro-6-nitrophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]acetamide|N-[4-(5-{[(2-CHLORO-6-NITROPHENYL)METHYL]SULFANYL}-4-METHYL-1,2,4-TRIAZOL-3-YL)PHENYL]ACETAMIDE|N-[4-[5-[(2-chloro-6-nitro-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]acetamide
| Molecular Formula | C18H16ClN5O3S |
|---|---|
| Molecular Weight | 417.06622 g/mol |
| LogP | 4.2944 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.06622 |
| Monoisotopic Mass | 417.06622 |
| Heavy Atoms | 28 |
| Complexity | 1036.2004 |
Chemical Identifiers
| CAS Number | 693235-95-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=C(C=CC=C3Cl)[N+](=O)[O-] |
Product Overview
AC1LPZX5 (CAS 693235-95-9), with molecular formula C18H16ClN5O3S and molecular weight 417.06622 g/mol. IUPAC: N-[4-[5-[(2-chloro-6-nitrophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]acetamide.
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