2-[4-oxidanylidene-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]ethanoate

Systemtic Name: 2-[4-oxidanylidene-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: 2-[4-oxo-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[4-oxo-5-(4-propoxyphenyl)-3-thieno[2,3-d]pyrimidinyl]acetate IUPAC Name: 2-[4-oxo-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[4-keto-5-(4-propoxyphenyl)thieno[2,3-d]pyrimidin-3-yl]acetate Formula: C17H15N2O4S- MolecularWeight: 343.377

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)[O-]

InChI

InChI=1S/C17H16N2O4S/c1-2-7-23-12-5-3-11(4-6-12)13-9-24-16-15(13)17(22)19(10-18-16)8-14(20)21/h3-6,9-10H,2,7-8H2,1H3,(H,20,21)/p-1