N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: 3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propanamide CAS Name: 3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]propanamide IUPAC Name: 3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propanamide Traditional Name: 3-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]propionamide Formula: C18H18N6O5S2 MolecularWeight: 462.50272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCSC3=NC(=CC(=O)N3)O

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCSC3=NC(=CC(=O)N3)O

InChI

InChI=1S/C18H18N6O5S2/c1-11-6-8-19-17(20-11)24-31(28,29)13-4-2-12(3-5-13)21-14(25)7-9-30-18-22-15(26)10-16(27)23-18/h2-6,8,10H,7,9H2,1H3,(H,21,25)(H,19,20,24)(H2,22,23,26,27)