2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(6-ethylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]isoindoline-1,3-quinone Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN=C2SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCC1=CC2=C(S1)N=CN=C2SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C17H13N3O2S2/c1-2-10-7-13-14(18-8-19-15(13)24-10)23-9-20-16(21)11-5-3-4-6-12(11)17(20)22/h3-8H,2,9H2,1H3