N-(3-cyanophenyl)-1-(2,5-dimethylphenyl)sulfonyl-cyclopentane-1-carboxamide

Systemtic Name: N-(3-cyanophenyl)-1-(2,5-dimethylphenyl)sulfonyl-cyclopentane-1-carboxamide Openeye Name: N-(3-cyanophenyl)-1-(2,5-dimethylphenyl)sulfonyl-cyclopentanecarboxamide CAS Name: N-(3-cyanophenyl)-1-(2,5-dimethylphenyl)sulfonyl-1-cyclopentanecarboxamide IUPAC Name: N-(3-cyanophenyl)-1-(2,5-dimethylphenyl)sulfonylcyclopentane-1-carboxamide Traditional Name: N-(3-cyanophenyl)-1-(2,5-dimethylphenyl)sulfonyl-cyclopentanecarboxamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H22N2O3S/c1-15-8-9-16(2)19(12-15)27(25,26)21(10-3-4-11-21)20(24)23-18-7-5-6-17(13-18)14-22/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,23,24)