2-[(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)amino]ethylazanium

Systemtic Name: 2-[(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)amino]ethylazanium Openeye Name: 2-[(3-allyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)amino]ethylammonium CAS Name: 2-[(5,6-dimethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)amino]ethylammonium IUPAC Name: 2-[(5,6-dimethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)amino]ethylazanium Traditional Name: 2-[(3-allyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)amino]ethylammonium Formula: C13H19N4OS+ MolecularWeight: 279.38116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)NCC[NH3+])CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)NCC[NH3+])CC=C)C

InChI

InChI=1S/C13H18N4OS/c1-4-7-17-12(18)10-8(2)9(3)19-11(10)16-13(17)15-6-5-14/h4H,1,5-7,14H2,2-3H3,(H,15,16)/p+1