AC1N3X21
N-[5-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide
Also Known As: SR-01000006575-1|F0509-2424|N-(5-((2-((4,5-dihydrothiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-3-nitrobenzamide|N-[5-({[(4,5-dihydro-1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide|N-[5-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide
| Molecular Formula | C15H14N6O4S3 |
|---|---|
| Molecular Weight | 438.02386 g/mol |
| LogP | 2.31812 |
| Topological Polar Surface Area | 139.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.02386 |
| Monoisotopic Mass | 438.02386 |
| Heavy Atoms | 28 |
| Complexity | 961.0029 |
Chemical Identifiers
| CAS Number | 393567-79-8 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)SCC(=O)NC3=NCCS3 |
Product Overview
AC1N3X21 (CAS 393567-79-8), with molecular formula C15H14N6O4S3 and molecular weight 438.02386 g/mol. IUPAC: N-[5-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitrobenzamide.
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