(2-cyanophenyl)methyl 2-(4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-(4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: (2-cyanophenyl)methyl 2-[4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-(4-oxo-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-[4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetic acid (2-cyanobenzyl) ester Formula: C20H13N3O3S2 MolecularWeight: 407.46552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CS4)C#N

InChI

InChI=1S/C20H13N3O3S2/c21-8-13-4-1-2-5-14(13)10-26-17(24)9-23-12-22-19-18(20(23)25)15(11-28-19)16-6-3-7-27-16/h1-7,11-12H,9-10H2