6-[2-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoyl]-4-prop-2-enyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoyl]-4-prop-2-enyl-1,4-benzoxazin-3-one Openeye Name: 4-allyl-6-[2-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoyl]-1,4-benzoxazin-3-one CAS Name: 6-[2-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-oxopropyl]-4-prop-2-enyl-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoyl]-4-prop-2-enyl-1,4-benzoxazin-3-one Traditional Name: 4-allyl-6-[2-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)propanoyl]-1,4-benzoxazin-3-one Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)C(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4CC=C

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)C(C)C(=O)C3=CC4=C(C=C3)OCC(=O)N4CC=C

InChI

InChI=1S/C22H21N3O4S/c1-4-8-24-17-9-14(6-7-18(17)29-11-19(24)26)20(27)13(3)25-12-23-21-16(22(25)28)10-15(5-2)30-21/h4,6-7,9-10,12-13H,1,5,8,11H2,2-3H3