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

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C15H10N2O4S MolecularWeight: 314.3159

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C15H10N2O4S/c18-11(9-1-2-12-13(5-9)21-8-20-12)6-17-7-16-14-10(15(17)19)3-4-22-14/h1-5,7H,6,8H2