ethyl 4-fluoranyl-3-[(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H15FN2O3S3 MolecularWeight: 434.527403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CSC3=NC4=C(C=CS4)C(=O)N3C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CSC3=NC4=C(C=CS4)C(=O)N3C

InChI

InChI=1S/C19H15FN2O3S3/c1-3-25-18(24)15-11(14-12(20)5-4-6-13(14)28-15)9-27-19-21-16-10(7-8-26-16)17(23)22(19)2/h4-8H,3,9H2,1-2H3