ethyl 2-(4-oxidanylidene-7-phenyl-2-sulfanylidene-1,5-dihydropyrrolo[3,2-d]pyrimidin-3-yl)ethanoate

Systemtic Name: ethyl 2-(4-oxidanylidene-7-phenyl-2-sulfanylidene-1,5-dihydropyrrolo[3,2-d]pyrimidin-3-yl)ethanoate Openeye Name: ethyl 2-(4-oxo-7-phenyl-2-thioxo-1,5-dihydropyrrolo[3,2-d]pyrimidin-3-yl)acetate CAS Name: 2-(4-oxo-7-phenyl-2-sulfanylidene-1,5-dihydropyrrolo[3,2-d]pyrimidin-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-oxo-7-phenyl-2-sulfanylidene-1,5-dihydropyrrolo[3,2-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-7-phenyl-2-thioxo-1,5-dihydropyrrolo[3,2-d]pyrimidin-3-yl)acetic acid ethyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)NC1=S

Isomeric SMILES

CCOC(=O)CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)NC1=S

InChI

InChI=1S/C16H15N3O3S/c1-2-22-12(20)9-19-15(21)14-13(18-16(19)23)11(8-17-14)10-6-4-3-5-7-10/h3-8,17H,2,9H2,1H3,(H,18,23)