6-azanyl-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-keto-2-(2,4,5-trimethylphenyl)ethyl]thio]-1H-pyrimidin-4-one Formula: C15H17N3O2S MolecularWeight: 303.37938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NC(=O)C=C(N2)N)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NC(=O)C=C(N2)N)C)C

InChI

InChI=1S/C15H17N3O2S/c1-8-4-10(3)11(5-9(8)2)12(19)7-21-15-17-13(16)6-14(20)18-15/h4-6H,7H2,1-3H3,(H3,16,17,18,20)