N-(2,3-dimethylcyclohexyl)-5-[(2-methylphenyl)sulfonylmethyl]furan-2-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-5-[(2-methylphenyl)sulfonylmethyl]furan-2-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-5-(o-tolylsulfonylmethyl)furan-2-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-5-[(2-methylphenyl)sulfonylmethyl]-2-furancarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-5-[(2-methylphenyl)sulfonylmethyl]furan-2-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-5-(o-tolylsulfonylmethyl)-2-furamide Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3C

InChI

InChI=1S/C21H27NO4S/c1-14-8-6-9-18(16(14)3)22-21(23)19-12-11-17(26-19)13-27(24,25)20-10-5-4-7-15(20)2/h4-5,7,10-12,14,16,18H,6,8-9,13H2,1-3H3,(H,22,23)