Basic information
- CAS
350698-63-4- Standard SMILES
CCOC(=O)c1c(NC(=O)c2cccnc2Cl)sc2c1CCCC2- InChIKey
LYFOHWPOCJRRDS-UHFFFAOYSA-N- Molecular formula
- C17H17ClN2O3S
- Average molar mass
- 364.8 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-{[(2-chloropyridin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
- IUPAC
- ethyl 2-[(2-chloropyridine-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
- English name
- ethyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
- Molecular formula
- C17H17ClN2O3S
- Molecular weight
- 364.84648
Names & synonyms
350698-63-4ETHYL 2-(2-CHLOROPYRIDINE-3-AMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATEethyl 2-{[(2-chloropyridin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylateOprea1_337467STK729861AKOS000438256CCG-285502ethyl 2-[(2-chloropyridine-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylateEU-0085612AG-205/13547035EN300-18108693SR-01000527247
Show more names
SR-01000527247-1Z27680679ethyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Database identifiers
- CAS
350698-63-4
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 479
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
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Compound notes
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