3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-6-ethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H14N2O4S/c1-2-11-6-12-16(24-11)18-8-19(17(12)21)7-13(20)10-3-4-14-15(5-10)23-9-22-14/h3-6,8H,2,7,9H2,1H3