1-(piperidin-3-ylmethyl)-2-sulfanylidene-5H-pyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 1-(piperidin-3-ylmethyl)-2-sulfanylidene-5H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 1-(3-piperidylmethyl)-2-thioxo-5H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 1-(3-piperidinylmethyl)-2-sulfanylidene-5H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 1-(piperidin-3-ylmethyl)-2-sulfanylidene-5H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 1-(3-piperidylmethyl)-2-thioxo-5H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)CN2C3=C(C(=O)NC2=S)NC=C3

Isomeric SMILES

C1CC(CNC1)CN2C3=C(C(=O)NC2=S)NC=C3

InChI

InChI=1S/C12H16N4OS/c17-11-10-9(3-5-14-10)16(12(18)15-11)7-8-2-1-4-13-6-8/h3,5,8,13-14H,1-2,4,6-7H2,(H,15,17,18)