6-[2-(3-ethyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3-ethyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3-ethyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(3-ethyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-ethyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(3-ethyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C21H21N3O4S2 MolecularWeight: 443.53914

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SC(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4)SC(=C2C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SC(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4)SC(=C2C)C

InChI

InChI=1S/C21H21N3O4S2/c1-5-24-20(27)17-10(2)11(3)29-19(17)23-21(24)30-12(4)18(26)13-6-7-15-14(8-13)22-16(25)9-28-15/h6-8,12H,5,9H2,1-4H3,(H,22,25)