ethyl 4-azanyl-2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)methylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C14H17N5O4S MolecularWeight: 351.38088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC2=CC(=O)N(C(=O)N2C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC2=CC(=O)N(C(=O)N2C)C

InChI

InChI=1S/C14H17N5O4S/c1-4-23-12(21)9-6-16-13(17-11(9)15)24-7-8-5-10(20)19(3)14(22)18(8)2/h5-6H,4,7H2,1-3H3,(H2,15,16,17)