isothiourea-1t
isothiourea-1t
SMILES | CC1(C)CN2C(CS/C(=N\C3CCCCC3)NC3CCCCC3)=CSC2=N1 |
InChIKey | OOSUDWRRWZVFEB-UHFFFAOYSA-N |
Chemical Properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 406.2 |
SMILES | CC1(C)CN2C(CS/C(=N\C3CCCCC3)NC3CCCCC3)=CSC2=N1 |
InChIKey | OOSUDWRRWZVFEB-UHFFFAOYSA-N |
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 406.2 |