5-(phenylmethyl)-1-(pyridin-2-ylmethyl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 5-(phenylmethyl)-1-(pyridin-2-ylmethyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 5-benzyl-1-(2-pyridylmethyl)-2-thioxo-pyrimidin-4-one CAS Name: 5-(phenylmethyl)-1-(2-pyridinylmethyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 5-benzyl-1-(pyridin-2-ylmethyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 5-benzyl-1-(2-pyridylmethyl)-2-thioxo-pyrimidin-4-one Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN(C(=S)NC2=O)CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN(C(=S)NC2=O)CC3=CC=CC=N3

InChI

InChI=1S/C17H15N3OS/c21-16-14(10-13-6-2-1-3-7-13)11-20(17(22)19-16)12-15-8-4-5-9-18-15/h1-9,11H,10,12H2,(H,19,21,22)