5-(phenylmethyl)-6-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(phenylmethyl)-6-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-benzyl-6-thioxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(phenylmethyl)-6-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-benzyl-6-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-benzyl-6-thioxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CNNC3=NC2=S

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CNNC3=NC2=S

InChI

InChI=1S/C12H10N4OS/c17-11-9-6-13-15-10(9)14-12(18)16(11)7-8-4-2-1-3-5-8/h1-6H,7H2,(H2,13,14,15,18)