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

Systemtic Name: 6-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4)C

InChI

InChI=1S/C18H15N3O3S2/c1-9-10(2)26-18-16(9)17(19-8-20-18)25-7-13(22)11-3-4-14-12(5-11)21-15(23)6-24-14/h3-5,8H,6-7H2,1-2H3,(H,21,23)