2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-pyrazin-2-yl-carbamic acid

Systemtic Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-pyrazin-2-yl-carbamic acid Openeye Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-pyrazin-2-yl-carbamic acid CAS Name: 2-[4-[[(cyclohexylamino)-oxomethyl]sulfamoyl]phenyl]ethyl-(2-pyrazinyl)carbamic acid IUPAC Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-pyrazin-2-ylcarbamic acid Traditional Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-pyrazin-2-yl-carbamic acid Formula: C20H25N5O5S MolecularWeight: 447.508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCN(C3=NC=CN=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCN(C3=NC=CN=C3)C(=O)O

InChI

InChI=1S/C20H25N5O5S/c26-19(23-16-4-2-1-3-5-16)24-31(29,30)17-8-6-15(7-9-17)10-13-25(20(27)28)18-14-21-11-12-22-18/h6-9,11-12,14,16H,1-5,10,13H2,(H,27,28)(H2,23,24,26)