3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 6-phenyl-3-[(E)-piperonylideneamino]thieno[2,3-d]pyrimidin-4-one Formula: C20H13N3O3S MolecularWeight: 375.40052

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NN3C=NC4=C(C3=O)C=C(S4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/N3C=NC4=C(C3=O)C=C(S4)C5=CC=CC=C5

InChI

InChI=1S/C20H13N3O3S/c24-20-15-9-18(14-4-2-1-3-5-14)27-19(15)21-11-23(20)22-10-13-6-7-16-17(8-13)26-12-25-16/h1-11H,12H2/b22-10+