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

Systemtic Name: 3-hexyl-5-methyl-4-oxidanylidene-N-phenyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-hexyl-5-methyl-4-oxo-N-phenyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-hexyl-5-methyl-4-oxo-N-phenyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-hexyl-5-methyl-4-oxo-N-phenylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-hexyl-4-keto-5-methyl-N-phenyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C20H23N3O2S/c1-3-4-5-9-12-23-13-21-19-16(20(23)25)14(2)17(26-19)18(24)22-15-10-7-6-8-11-15/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,22,24)