2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-(6-methylpyrazin-2-yl)carbamic acid

Systemtic Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-(6-methylpyrazin-2-yl)carbamic acid Openeye Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-(6-methylpyrazin-2-yl)carbamic acid CAS Name: 2-[4-[[(cyclohexylamino)-oxomethyl]sulfamoyl]phenyl]ethyl-(6-methyl-2-pyrazinyl)carbamic acid IUPAC Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-(6-methylpyrazin-2-yl)carbamic acid Traditional Name: 2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl-(6-methylpyrazin-2-yl)carbamic acid Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CC(=N1)N(CCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3)C(=O)O

Isomeric SMILES

CC1=CN=CC(=N1)N(CCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3)C(=O)O

InChI

InChI=1S/C21H27N5O5S/c1-15-13-22-14-19(23-15)26(21(28)29)12-11-16-7-9-18(10-8-16)32(30,31)25-20(27)24-17-5-3-2-4-6-17/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,28,29)(H2,24,25,27)