2-[(2,5-dimethylphenyl)sulfanylmethyl]-N,N-diethyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-N,N-diethyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-N,N-diethyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-[[(2,5-dimethylphenyl)thio]methyl]-N,N-diethyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-N,N-diethyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-[[(2,5-dimethylphenyl)thio]methyl]-N,N-diethyl-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=C(C=CC(=C3)C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=C(C=CC(=C3)C)C)C

InChI

InChI=1S/C21H25N3O2S2/c1-6-24(7-2)21(26)18-14(5)17-19(25)22-16(23-20(17)28-18)11-27-15-10-12(3)8-9-13(15)4/h8-10H,6-7,11H2,1-5H3,(H,22,23,25)