Ethyl 2-(3-amino-2-benzoylimino-1,3-thiazol-4-yl)acetate
Basic information
- CAS
66870-59-5- Standard SMILES
CCOC(=O)Cc1csc(=NC(=O)c2ccccc2)n1N- InChIKey
DFHJOJVDRJQZIB-UHFFFAOYSA-N- Molecular formula
- C14H15N3O3S
- Average molar mass
- 305.35 g/mol
- Monoisotopic mass
- 305.08341252
Names & identifiers
- Preferred name
- Ethyl 2-(3-amino-2-benzoylimino-1,3-thiazol-4-yl)acetate
- IUPAC
- ethyl 2-(3-amino-2-benzoylimino-1,3-thiazol-4-yl)acetate
Names & synonyms
NSC29996566870-59-5ethyl 2-(3-amino-2-benzoylimino-1,3-thiazol-4-yl)acetateDTXSID60316154NSC-299965DS-000644ethyl 2-[(2E)-3-amino-2-benzoylimino-thiazol-4-yl]acetateethyl 2-[(2Z)-3-amino-2-benzoylimino-1,3-thiazol-4-yl]acetate4-Thiazoleacetic acid, 3-amino-2-(benzoylimino)-2,3-dihydro-, ethyl ester, (2E)-Ethyl [(2Z)-3-amino-2-(benzoylimino)-2,3-dihydro-1,3-thiazol-4-yl]acetate
Database identifiers
- CAS
66870-59-5- PubChem CID
- 327016
- DTXSID
DTXSID60316154
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 470
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Related reactions
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Compound notes
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