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

Systemtic Name: ethyl 2-[(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: ethyl 2-[(3-allyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[(5,6-dimethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5,6-dimethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[(3-allyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]furan-3-carboxylic acid ethyl ester Formula: C19H20N2O4S2 MolecularWeight: 404.5031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC=C

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC=C

InChI

InChI=1S/C19H20N2O4S2/c1-5-8-21-17(22)15-11(3)12(4)27-16(15)20-19(21)26-10-14-13(7-9-25-14)18(23)24-6-2/h5,7,9H,1,6,8,10H2,2-4H3