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

Systemtic Name: (6-ethoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: (6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (6-carbethoxy-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C18H22N3O3S2+ MolecularWeight: 392.51558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C[NH+](C)CC3=C(C=CS3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C[NH+](C)CC3=C(C=CS3)C)C

InChI

InChI=1S/C18H21N3O3S2/c1-5-24-18(23)15-11(3)14-16(22)19-13(20-17(14)26-15)9-21(4)8-12-10(2)6-7-25-12/h6-7H,5,8-9H2,1-4H3,(H,19,20,22)/p+1