N-(3-ethynylphenyl)-3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-ethynylphenyl)-3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-ethynylphenyl)-3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-ethynylphenyl)-4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C17H13N3O2S/c1-4-11-6-5-7-12(8-11)19-15(21)14-10(2)13-16(23-14)18-9-20(3)17(13)22/h1,5-9H,2-3H3,(H,19,21)