Molecule ID: 10668

IUPAC Name: N,N-dimethyl-4,4-dithiophen-2-ylbut-3-en-2-amine

Description: The molecule is n,N-Dimethylbut-3-en-2-amine in which each of the hydrogens at position 4 is substituted by a 2-thienyl group. An opioid analgesic drug, it is controlled under the UN Single Convention on Narcotic Drugs (1961), but is used in veterinary medicine, particularly in Japan. It has a role as an opioid analgesic. It is a member of thiophenes and a tertiary amine.

SMILES: CC(C=C(c1cccs1)c1cccs1)N(C)C

SELFIES: [C][C][Branch2][Ring1][Ring1][C][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][C][=C][C][=C][S][Ring1][Branch1][N][Branch1][C][C][C]

InChI: InChI=1S/C14H17NS2/c1-11(15(2)3)10-12(13-6-4-8-16-13)14-7-5-9-17-14/h4-11H,1-3H3

Molecular Properties:
- Polar Surface Area: 59.7 Ų
- LogP: 4.1