3-hexyl-N-(2-methoxyphenyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-hexyl-N-(2-methoxyphenyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-hexyl-N-(2-methoxyphenyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-hexyl-N-(2-methoxyphenyl)-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-hexyl-N-(2-methoxyphenyl)-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-hexyl-4-keto-N-(2-methoxyphenyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3OC)C

Isomeric SMILES

CCCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3OC)C

InChI

InChI=1S/C21H25N3O3S/c1-4-5-6-9-12-24-13-22-20-17(21(24)26)14(2)18(28-20)19(25)23-15-10-7-8-11-16(15)27-3/h7-8,10-11,13H,4-6,9,12H2,1-3H3,(H,23,25)