N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[4-[(3-methoxy-2-pyrazinyl)sulfamoyl]anilino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]thiocarbamoyl]adamantane-1-carboxamide Formula: C23H27N5O4S2 MolecularWeight: 501.62158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27N5O4S2/c1-32-20-19(24-6-7-25-20)28-34(30,31)18-4-2-17(3-5-18)26-22(33)27-21(29)23-11-14-8-15(12-23)10-16(9-14)13-23/h2-7,14-16H,8-13H2,1H3,(H,24,28)(H2,26,27,29,33)