Molecule ID: 11174640

IUPAC Name: N-[cyano(thiophen-2-yl)methyl]-4-ethyl-2-(ethylamino)-1,3-thiazole-5-carboxamide

Description: The molecule is a member of the class of aromatic amides obtained by formal condensation of the carboxy group of 4-ethyl-2-(ethylamino)-1,3-thiazole-5-carboxylic acid with the amino group of amino(2-thienyl)acetonitrile. It is an aromatic amide, an aromatic amine, a secondary amino compound, a member of 1,3-thiazoles, a member of thiophenes and a nitrile.

SMILES: CCN=c1[nH]c(CC)c(C(O)=NC(C#N)c2cccs2)s1

SELFIES: [C][C][N][=C][NH1][C][Branch1][Ring1][C][C][=C][Branch2][Ring1][C][C][Branch1][C][O][=N][C][Branch1][Ring1][C][#N][C][=C][C][=C][S][Ring1][Branch1][S][Ring2][Ring1][C]

InChI: InChI=1S/C14H16N4OS2/c1-3-9-12(21-14(18-9)16-4-2)13(19)17-10(8-15)11-6-5-7-20-11/h5-7,10H,3-4H2,1-2H3,(H,16,18)(H,17,19)

Molecular Properties:
- Polar Surface Area: 134.0 Ų
- LogP: 3.3