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EC number: 255-799-0 | CAS number: 42399-49-5
Reference substances
- IUPAC name:
- (2S-cis)-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
Inventory
- EC number:
- 255-799-0
- EC name:
- (2S-cis)-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
- CAS number:
- 42399-49-5
- CAS number:
- 42399-49-5
Synonyms
- Names:
- 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-, (2S-cis)-
- DTZ62
- Identifier:
- IUPAC name
- (2S,3S)-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
- Identifier:
- IUPAC name
- 3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
- Identifier:
- other: InChl
- InChI=1/C16H15NO3S/c1-20-11-8-6-10(7-9-11)15-14(18)16(19)17-12-4-2-3-5-13(12)21-15/h2-9,14-15,18H,1H3,(H,17,19)
- (2S-cis)-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
Molecular and structural information
- Molecular formula:
- C16H15NO3S
- Molecular weight:
- 301.36
- SMILES notation:
- COc1ccc(cc1)[C@@H]2Sc3ccccc3NC(=O)[C@@H]2O
- InChl:
- 1/C16H15NO3S/c1-20-11-8-6-10(7-9-11)15-14(18)16(19)17-12-4-2-3-5-13(12)21-15/h2-9,14-15,18H,1H3,(H,17,19)/t14-,15+/m1/s1/f/h17H
- Structural formula:
Related substances
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