2-[[5-(2,4-dimethylphenyl)-3-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium

Systemtic Name: 2-[[5-(2,4-dimethylphenyl)-3-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Openeye Name: 2-[[5-(2,4-dimethylphenyl)-3-ethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium CAS Name: 2-[[5-(2,4-dimethylphenyl)-3-ethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[5-(2,4-dimethylphenyl)-3-ethyl-4-oxothieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Traditional Name: 2-[[5-(2,4-dimethylphenyl)-3-ethyl-4-keto-thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium Formula: C18H23N4OS+ MolecularWeight: 343.46642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1NCC[NH3+])SC=C2C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1NCC[NH3+])SC=C2C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C18H22N4OS/c1-4-22-17(23)15-14(13-6-5-11(2)9-12(13)3)10-24-16(15)21-18(22)20-8-7-19/h5-6,9-10H,4,7-8,19H2,1-3H3,(H,20,21)/p+1