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

Systemtic Name: (2,4-dimethylphenyl)methyl-[(6-methoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-methyl-azanium Openeye Name: (2,4-dimethylphenyl)methyl-[(6-methoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-methyl-ammonium CAS Name: (2,4-dimethylphenyl)methyl-[(6-methoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-methylammonium IUPAC Name: (2,4-dimethylphenyl)methyl-[(6-methoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-methylazanium Traditional Name: (6-carbomethoxy-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(2,4-dimethylbenzyl)-methyl-ammonium Formula: C20H24N3O3S+ MolecularWeight: 386.48786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+](C)CC2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+](C)CC2=NC3=C(C(=C(S3)C(=O)OC)C)C(=O)N2)C

InChI

InChI=1S/C20H23N3O3S/c1-11-6-7-14(12(2)8-11)9-23(4)10-15-21-18(24)16-13(3)17(20(25)26-5)27-19(16)22-15/h6-8H,9-10H2,1-5H3,(H,21,22,24)/p+1