2-[5-(3,4-dimethylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[5-(3,4-dimethylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-[5-(3,4-dimethylphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-prop-2-ynyl-acetamide CAS Name: 2-[5-(3,4-dimethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-prop-2-ynylacetamide IUPAC Name: 2-[5-(3,4-dimethylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-prop-2-ynylacetamide Traditional Name: 2-[5-(3,4-dimethylphenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]-N-propargyl-acetamide Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)NCC#C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)NCC#C)C

InChI

InChI=1S/C19H17N3O2S/c1-4-7-20-16(23)9-22-11-21-18-17(19(22)24)15(10-25-18)14-6-5-12(2)13(3)8-14/h1,5-6,8,10-11H,7,9H2,2-3H3,(H,20,23)