3-[2-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]ethyl]-1,3-benzoxazol-2-one Formula: C22H17N3O3S2 MolecularWeight: 435.51868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCN3C4=CC=CC=C4OC3=O)SC=C2C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCN3C4=CC=CC=C4OC3=O)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C22H17N3O3S2/c1-24-20(26)18-15(14-7-3-2-4-8-14)13-30-19(18)23-21(24)29-12-11-25-16-9-5-6-10-17(16)28-22(25)27/h2-10,13H,11-12H2,1H3