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

Systemtic Name: ethyl 2-[(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: ethyl 2-[(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]furan-3-carboxylic acid ethyl ester Formula: C17H16N2O4S2 MolecularWeight: 376.44994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CSC2=NC3=C(C=CS3)C(=O)N2CC=C

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CSC2=NC3=C(C=CS3)C(=O)N2CC=C

InChI

InChI=1S/C17H16N2O4S2/c1-3-7-19-15(20)12-6-9-24-14(12)18-17(19)25-10-13-11(5-8-23-13)16(21)22-4-2/h3,5-6,8-9H,1,4,7,10H2,2H3