2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C17H22N4O4S2 MolecularWeight: 410.51098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H22N4O4S2/c1-2-3-13-10-15(22)21-17(20-13)26-11-16(23)19-9-8-12-4-6-14(7-5-12)27(18,24)25/h4-7,10H,2-3,8-9,11H2,1H3,(H,19,23)(H2,18,24,25)(H,20,21,22)