5-Prop-1-en-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Basic information
- CAS
74607-18-4- Standard SMILES
C=CCC1(C(=C)C)C(=O)NC(=S)NC1=O- InChIKey
SSUYWHMIJSBCCK-UHFFFAOYSA-N- Molecular formula
- C10H12N2O2S
- Average molar mass
- 224.28 g/mol
- Monoisotopic mass
- 224.0619488
Names & identifiers
- Preferred name
- 5-Prop-1-en-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
- IUPAC
- 5-prop-1-en-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Names & synonyms
74607-18-4NSC1257245-prop-1-en-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dioneDTXSID80398513NSC-1257245-(Prop-1-en-2-yl)-5-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Database identifiers
- CAS
74607-18-4- PubChem CID
- 4011102
- DTXSID
DTXSID80398513
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 90.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 354
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Compound notes
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