N-[4-[(6-azanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[(6-azanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)sulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[(6-amino-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)sulfamoyl]phenyl]acetamide CAS Name: N-[4-[[6-amino-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[(6-amino-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)sulfamoyl]phenyl]acetamide Traditional Name: N-[4-[[6-amino-4-keto-2-(methylthio)-1H-pyrimidin-5-yl]sulfamoyl]phenyl]acetamide Formula: C13H15N5O4S2 MolecularWeight: 369.4193

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(NC(=NC2=O)SC)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(NC(=NC2=O)SC)N

InChI

InChI=1S/C13H15N5O4S2/c1-7(19)15-8-3-5-9(6-4-8)24(21,22)18-10-11(14)16-13(23-2)17-12(10)20/h3-6,18H,1-2H3,(H,15,19)(H3,14,16,17,20)