2-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC(C)C3=NC(=O)C4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC(C)C3=NC(=O)C4=CC=CC=C4N3)C

InChI

InChI=1S/C18H16N4OS2/c1-9-10(2)24-17-14(9)18(20-8-19-17)25-11(3)15-21-13-7-5-4-6-12(13)16(23)22-15/h4-8,11H,1-3H3,(H,21,22,23)