AC1M3JJ5
N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
Also Known As: AR-196/42726592|N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide|N-[(4-allyl-5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-2-thiophenecarboxamide|N-{[5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
| Molecular Formula | C20H18N6O2S3 |
|---|---|
| Molecular Weight | 470.06534 g/mol |
| LogP | 3.7961 |
| Topological Polar Surface Area | 101.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.06534 |
| Monoisotopic Mass | 470.06534 |
| Heavy Atoms | 31 |
| Complexity | 1181.9514 |
Chemical Identifiers
| CAS Number | 708293-13-4 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)CNC(=O)C4=CC=CS4 |
Product Overview
AC1M3JJ5 (CAS 708293-13-4), with molecular formula C20H18N6O2S3 and molecular weight 470.06534 g/mol. IUPAC: N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide.
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