Basic information
- CAS
577696-40-3- Standard SMILES
COc1cc2c(cc1NC(=O)CSc1nnc(-c3cccs3)n1C)oc1ccccc12- InChIKey
PRANHFDJJCEQIA-UHFFFAOYSA-N- Molecular formula
- C22H18N4O3S2
- Average molar mass
- 450.5 g/mol
Names & identifiers
- Preferred name
- N-(2-methoxydibenzofuran-3-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
- IUPAC
- N-(2-methoxydibenzofuran-3-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
- English name
- Acetamide, N-(2-methoxy-3-dibenzofuranyl)-2-[[4-methyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio]- (9CI)
- Molecular formula
- C22H18N4O3S2
- Molecular weight
- 450.53
Names & synonyms
577696-40-3Acetamide, N-(2-methoxy-3-dibenzofuranyl)-2-[[4-methyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio]- (9CI)ACETAMIDE,N-(2-METHOXY-3-DIBENZOFURANYL)-2-[[4-METHYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-AKOS002186452Acetamide, N-(2-methoxy-3-dibenzofuranyl)-2-[[4-methyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio]-
Database identifiers
- CAS
577696-40-3
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 644
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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