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

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-4-oxidanylidene-N-pentyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-4-oxo-N-pentyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-[[(2,5-dimethylphenyl)thio]methyl]-5-methyl-4-oxo-N-pentyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-4-oxo-N-pentyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-amyl-2-[[(2,5-dimethylphenyl)thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H27N3O2S2 MolecularWeight: 429.59868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S2/c1-5-6-7-10-23-21(27)19-15(4)18-20(26)24-17(25-22(18)29-19)12-28-16-11-13(2)8-9-14(16)3/h8-9,11H,5-7,10,12H2,1-4H3,(H,23,27)(H,24,25,26)