4-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]cyclohexane-1-carboxamide

Systemtic Name: 4-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]cyclohexane-1-carboxamide Openeye Name: 4-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]cyclohexanecarboxamide CAS Name: 4-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]cyclohexane-1-carboxamide Traditional Name: 4-(tert-butylsulfonylamino)-N-[4-(3-pyrrolin-1-yl)phenyl]cyclohexanecarboxamide Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)N3CC=CC3

Isomeric SMILES

CC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)N3CC=CC3

InChI

InChI=1S/C21H31N3O3S/c1-21(2,3)28(26,27)23-18-8-6-16(7-9-18)20(25)22-17-10-12-19(13-11-17)24-14-4-5-15-24/h4-5,10-13,16,18,23H,6-9,14-15H2,1-3H3,(H,22,25)