Basic information
- CAS
178870-13-8- Standard SMILES
C=CCOc1cc(NC(=S)c2ccoc2C)ccc1OC- InChIKey
MEAQEWKWEUTTNV-UHFFFAOYSA-N- Molecular formula
- C16H17NO3S
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.09291458
Names & identifiers
- Preferred name
- 3-Furancarbothioamide, N-(4-methoxy-3-(2-propenyloxy)phenyl)-2-methyl-
- IUPAC
- N-(4-methoxy-3-prop-2-enoxyphenyl)-2-methylfuran-3-carbothioamide
Names & synonyms
UC39RS28UCN0G2178870-13-8UNII-RS28UCN0G2NSC 6500643-Furancarbothioamide, N-(4-methoxy-3-(2-propenyloxy)phenyl)-2-methyl-2-Methyl-furan-3-carbothioic acid, (3-allyloxy-4-methoxy-phenyl)-amideNSC650064NSC-650064N-(4-Methoxy-3-(2-propenyloxy)phenyl)-2-methyl-3-furancarbothioamide3-Furancarbothioamide, N-[4-methoxy-3-(2-propenyloxy)phenyl]-2-methyl-CHEMBL1964349
Show more names
SCHEMBL29616844DTXSID30170568NCI60_017495N-(3-allyloxy-4-methoxy-phenyl)-2-methyl-furan-3-carbothioamide3-Furancarbothioamide, N-[4-methoxy-3-(2-propenyloxy) phenyl]-2-methyl-3-FURANCARBOTHIOAMIDE, N-(4-METHOXY-3-(2-PROPEN-1-YLOXY)PHENYL)-2-METHYL-N-{4-Methoxy-3-[(prop-2-en-1-yl)oxy]phenyl}-2-methylfuran-3-carbothioamide
Database identifiers
- CAS
178870-13-8- PubChem CID
- 3000889
- DTXSID
DTXSID30170568- ChEMBL
CHEMBL1964349- UNII
- RS28UCN0G2
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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