(4-azanyl-6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: (4-azanyl-6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: (4-amino-6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-(p-tolylmethyl)ammonium CAS Name: (4-amino-6-ethoxycarbonyl-5-methyl-2-thieno[2,3-d]pyrimidinyl)methyl-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: (4-amino-6-ethoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-2-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (4-amino-6-carbethoxy-5-methyl-thieno[2,3-d]pyrimidin-2-yl)methyl-methyl-(4-methylbenzyl)ammonium Formula: C20H25N4O2S+ MolecularWeight: 385.5031

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C[NH+](C)CC3=CC=C(C=C3)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C[NH+](C)CC3=CC=C(C=C3)C)N)C

InChI

InChI=1S/C20H24N4O2S/c1-5-26-20(25)17-13(3)16-18(21)22-15(23-19(16)27-17)11-24(4)10-14-8-6-12(2)7-9-14/h6-9H,5,10-11H2,1-4H3,(H2,21,22,23)/p+1