N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]cyclohexanecarboxamide

Systemtic Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonyl-phenyl]cyclohexanecarboxamide Openeye Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]cyclohexanecarboxamide CAS Name: N-[2-(butylamino)-5-(4-morpholinylsulfonyl)phenyl]cyclohexanecarboxamide IUPAC Name: N-[2-(butylamino)-5-morpholin-4-ylsulfonylphenyl]cyclohexanecarboxamide Traditional Name: N-[2-(butylamino)-5-morpholinosulfonyl-phenyl]cyclohexanecarboxamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3CCCCC3

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3CCCCC3

InChI

InChI=1S/C21H33N3O4S/c1-2-3-11-22-19-10-9-18(29(26,27)24-12-14-28-15-13-24)16-20(19)23-21(25)17-7-5-4-6-8-17/h9-10,16-17,22H,2-8,11-15H2,1H3,(H,23,25)