CAS Registry Number®
76-75-5
CAS Name
(±)-Thiopental
Molecular Formula
C11H18N2O2S
Molecular Mass
242.34
Compound Properties
-
Melting Point (1)
158-159 °C
Source(s)
- (1) Volwiler, Ernest H.; US2153729, 1939, CAplus
Other Names and Identifiers
InChI
InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKey
InChIKey=IUJDSEJGGMCXSG-UHFFFAOYSA-N
SMILES
C(CCC)(C)C1(CC)C(=O)NC(=S)NC1=O
Canonical SMILES
O=C1NC(=S)NC(=O)C1(CC)C(C)CCC
Other Names for this Substance
- 4,6(1H,5H)-Pyrimidinedione, 5-ethyldihydro-5-(1-methylbutyl)-2-thioxo-
- Barbituric acid, 5-ethyl-5-(1-methylbutyl)-2-thio-
- 5-Ethyldihydro-5-(1-methylbutyl)-2-thioxo-4,6(1H,5H)-pyrimidinedione
- Intraval
- Penthiobarbital
- Thiomebumal
- Thiopental
- Thiopentone
- Thiothal
- 5-Ethyl-5-(1-methylbutyl)-2-thiobarbituric acid
- Thiopentobarbital
- 2-Thio-5-ethyl-5-sec-pentylbarbituric acid
- Thiopentobarbituric acid
- Pentothiobarbital
- Thiopentobarbitone
- Thionembutal
- (±)-Thiopental
- MeSH ID: D013874
Deleted or Replaced CAS Registry Numbers
59709-53-4