2-[(4-azanyl-1-methyl-5-nitroso-6-oxidanylidene-pyrimidin-2-yl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(4-azanyl-1-methyl-5-nitroso-6-oxidanylidene-pyrimidin-2-yl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(4-amino-1-methyl-5-nitroso-6-oxo-pyrimidin-2-yl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(4-amino-1-methyl-5-nitroso-6-oxo-2-pyrimidinyl)amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(4-amino-1-methyl-5-nitroso-6-oxopyrimidin-2-yl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-amino-6-keto-1-methyl-5-nitroso-pyrimidin-2-yl)amino]-4-(methylthio)butyric acid Formula: C10H15N5O4S MolecularWeight: 301.3222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1NC(CCSC)C(=O)O)N)N=O

Isomeric SMILES

CN1C(=O)C(=C(N=C1NC(CCSC)C(=O)O)N)N=O

InChI

InChI=1S/C10H15N5O4S/c1-15-8(16)6(14-19)7(11)13-10(15)12-5(9(17)18)3-4-20-2/h5H,3-4,11H2,1-2H3,(H,12,13)(H,17,18)