N-(cyanomethyl)-2-[(4-fluorophenyl)sulfonylmethyl]-4-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-(cyanomethyl)-2-[(4-fluorophenyl)sulfonylmethyl]-4-methyl-cyclohexane-1-carboxamide Openeye Name: N-(cyanomethyl)-2-[(4-fluorophenyl)sulfonylmethyl]-4-methyl-cyclohexanecarboxamide CAS Name: N-(cyanomethyl)-2-[(4-fluorophenyl)sulfonylmethyl]-4-methyl-1-cyclohexanecarboxamide IUPAC Name: N-(cyanomethyl)-2-[(4-fluorophenyl)sulfonylmethyl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-(cyanomethyl)-2-[(4-fluorophenyl)sulfonylmethyl]-4-methyl-cyclohexanecarboxamide Formula: C17H21FN2O3S MolecularWeight: 352.423643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)CS(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC#N

Isomeric SMILES

CC1CCC(C(C1)CS(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC#N

InChI

InChI=1S/C17H21FN2O3S/c1-12-2-7-16(17(21)20-9-8-19)13(10-12)11-24(22,23)15-5-3-14(18)4-6-15/h3-6,12-13,16H,2,7,9-11H2,1H3,(H,20,21)