5-phenylmethoxy-2-[2-(1,2,5-thiadiazol-3-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-phenylmethoxy-2-[2-(1,2,5-thiadiazol-3-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-benzyloxy-2-[2-(1,2,5-thiadiazol-3-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one CAS Name: 5-phenylmethoxy-2-[2-(1,2,5-thiadiazol-3-ylmethylthio)ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-phenylmethoxy-2-[2-(1,2,5-thiadiazol-3-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-benzoxy-2-[2-(1,2,5-thiadiazol-3-ylmethylthio)ethylamino]-1H-pyrimidin-6-one Formula: C16H17N5O2S2 MolecularWeight: 375.46848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CN=C(NC2=O)NCCSCC3=NSN=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CN=C(NC2=O)NCCSCC3=NSN=C3

InChI

InChI=1S/C16H17N5O2S2/c22-15-14(23-10-12-4-2-1-3-5-12)9-18-16(20-15)17-6-7-24-11-13-8-19-25-21-13/h1-5,8-9H,6-7,10-11H2,(H2,17,18,20,22)