(6-ethoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-prop-2-enyl-azanium

Systemtic Name: (6-ethoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-prop-2-enyl-azanium Openeye Name: allyl-[(6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium CAS Name: (6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-prop-2-enylammonium IUPAC Name: (6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-prop-2-enylazanium Traditional Name: allyl-[(6-carbethoxy-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium Formula: C14H18N3O3S+ MolecularWeight: 308.37602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C[NH2+]CC=C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C[NH2+]CC=C)C

InChI

InChI=1S/C14H17N3O3S/c1-4-6-15-7-9-16-12(18)10-8(3)11(14(19)20-5-2)21-13(10)17-9/h4,15H,1,5-7H2,2-3H3,(H,16,17,18)/p+1