N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-isothiocyanato-2-methoxy-benzamide

Systemtic Name: N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-isothiocyanato-2-methoxy-benzamide Openeye Name: N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-isothiocyanato-2-methoxy-benzamide CAS Name: N-[2-[4-[[(cyclohexylamino)-oxomethyl]sulfamoyl]phenyl]ethyl]-5-isothiocyanato-2-methoxybenzamide IUPAC Name: N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-isothiocyanato-2-methoxybenzamide Traditional Name: N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-isothiocyanato-2-methoxy-benzamide Formula: C24H28N4O5S2 MolecularWeight: 516.63292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N=C=S)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)N=C=S)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C24H28N4O5S2/c1-33-22-12-9-19(26-16-34)15-21(22)23(29)25-14-13-17-7-10-20(11-8-17)35(31,32)28-24(30)27-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,29)(H2,27,28,30)