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

Systemtic Name: methyl 2-[(4-oxidanylidene-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-[(3-allyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[(4-oxo-5-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-oxo-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[(3-allyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]furan-3-carboxylic acid methyl ester Formula: C22H18N2O4S2 MolecularWeight: 438.51932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC=C

Isomeric SMILES

COC(=O)C1=C(OC=C1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC=C

InChI

InChI=1S/C22H18N2O4S2/c1-3-10-24-20(25)18-16(14-7-5-4-6-8-14)12-29-19(18)23-22(24)30-13-17-15(9-11-28-17)21(26)27-2/h3-9,11-12H,1,10,13H2,2H3