N-[4-(2,5-dihydropyrrol-1-yl)-2-methyl-phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC=CC2)NC(=O)C3CCC(CC3)NS(=O)(=O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC=CC2)NC(=O)C3CCC(CC3)NS(=O)(=O)C(C)C

InChI

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