2-azanyl-5-(2-prop-2-enylsulfanylethyl)-1H-pyrimidine-4,6-dione

Systemtic Name: 2-azanyl-5-(2-prop-2-enylsulfanylethyl)-1H-pyrimidine-4,6-dione Openeye Name: 5-(2-allylsulfanylethyl)-2-amino-1H-pyrimidine-4,6-dione CAS Name: 2-amino-5-[2-(prop-2-enylthio)ethyl]-1H-pyrimidine-4,6-dione IUPAC Name: 2-amino-5-(2-prop-2-enylsulfanylethyl)-1H-pyrimidine-4,6-dione Traditional Name: 5-[2-(allylthio)ethyl]-2-amino-1H-pyrimidine-4,6-quinone Formula: C9H13N3O2S MolecularWeight: 227.28342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSCCC1C(=O)NC(=NC1=O)N

Isomeric SMILES

C=CCSCCC1C(=O)NC(=NC1=O)N

InChI

InChI=1S/C9H13N3O2S/c1-2-4-15-5-3-6-7(13)11-9(10)12-8(6)14/h2,6H,1,3-5H2,(H3,10,11,12,13,14)