(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-phenylazanylphenoxy)ethanoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-phenylazanylphenoxy)ethanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-anilinophenoxy)acetate CAS Name: 2-(4-anilinophenoxy)acetic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(4-anilinophenoxy)acetate Traditional Name: 2-(4-anilinophenoxy)acetic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)OCC(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)OCC(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C21H17N3O4S/c25-19(28-12-18-23-17-10-11-29-20(17)21(26)24-18)13-27-16-8-6-15(7-9-16)22-14-4-2-1-3-5-14/h1-11,22H,12-13H2,(H,23,24,26)