6-[2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C18H15N3O4S2 MolecularWeight: 401.4594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=C(C=CS4)C(=O)N3C

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC4=C(C=CS4)C(=O)N3C

InChI

InChI=1S/C18H15N3O4S2/c1-9(27-18-20-16-11(5-6-26-16)17(24)21(18)2)15(23)10-3-4-13-12(7-10)19-14(22)8-25-13/h3-7,9H,8H2,1-2H3,(H,19,22)