ethyl 4-[2-(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(3-allyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[2-[(5,6-dimethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5,6-dimethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(3-allyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC=C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC=C

InChI

InChI=1S/C19H25N3O4S2/c1-5-10-22-18(25)16-12(3)13(4)28-17(16)21-19(22)27-11-14(23)20-9-7-8-15(24)26-6-2/h5H,1,6-11H2,2-4H3,(H,20,23)