AC1MCJFP
3-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one
Also Known As: J1.668.991B|AB00687126-01|SR-01000019077-1|F1923-0041|3-{[4-(4-methoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]methyl}-2,3-dihydro-1,3-benzothiazol-2-one|3-[[5-Thioxo-4-(4-methoxyphenyl)-1H-1,2,4-triazole-3-yl]methyl]benzothiazole-2(3H)-one|3-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one|3-((5-mercapto-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)methyl)benzo[d]thiazol-2(3H)-one|3-{[4-(4-methoxyphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-2,3-dihydro-1,3-benzothiazol-2-one
| Molecular Formula | C17H14N4O2S2 |
|---|---|
| Molecular Weight | 370.05582 g/mol |
| LogP | 3.36319 |
| Topological Polar Surface Area | 64.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.05582 |
| Monoisotopic Mass | 370.05582 |
| Heavy Atoms | 25 |
| Complexity | 1151.8213 |
Chemical Identifiers
| CAS Number | 390748-34-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=NNC2=S)CN3C4=CC=CC=C4SC3=O |
Product Overview
AC1MCJFP (CAS 390748-34-2), with molecular formula C17H14N4O2S2 and molecular weight 370.05582 g/mol. IUPAC: 3-[[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-1,3-benzothiazol-2-one.