N-[(5-phenyltetrazol-1-yl)methyl]-2-prop-2-enylsulfanyl-1,3-benzothiazol-6-amine
N-[(5-phenyltetrazol-1-yl)methyl]-2-prop-2-enylsulfanyl-1,3-benzothiazol-6-amine
| Molecular Formula | C18H16N6S2 |
|---|---|
| Molecular Weight | 380.5 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 122.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.0878 |
| Heavy Atoms | 26 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 82746-87-0 |
|---|---|
| SMILES | C=CCSC1=NC2=C(S1)C=C(C=C2)NCN3C(=NN=N3)C4=CC=CC=C4 |
| InChIKey | OKLMEWBHLIECCB-UHFFFAOYSA-N |
📖 Product Overview
N-[(5-phenyltetrazol-1-yl)methyl]-2-prop-2-enylsulfanyl-1,3-benzothiazol-6-amine (CAS: 82746-87-0) is a chemical compound with molecular formula C18H16N6S2 and molecular weight 380.5 g/mol. Its IUPAC systematic name is N-[(5-phenyltetrazol-1-yl)methyl]-2-prop-2-enylsulfanyl-1,3-benzothiazol-6-amine.
OKLMEWBHLIECCB-UHFFFAOYSA-N.
SMILES: C=CCSC1=NC2=C(S1)C=C(C=C2)NCN3C(=NN=N3)C4=CC=CC=C4.
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