1-(3,4-dimethylphenyl)sulfonyl-N-[4-(3-methylbutanoylamino)phenyl]cyclopentane-1-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(3-methylbutanoylamino)phenyl]cyclopentane-1-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(3-methylbutanoylamino)phenyl]cyclopentanecarboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(3-methylbutanoylamino)phenyl]cyclopentane-1-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(isovalerylamino)phenyl]cyclopentanecarboxamide Formula: C25H32N2O4S MolecularWeight: 456.59758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O4S/c1-17(2)15-23(28)26-20-8-10-21(11-9-20)27-24(29)25(13-5-6-14-25)32(30,31)22-12-7-18(3)19(4)16-22/h7-12,16-17H,5-6,13-15H2,1-4H3,(H,26,28)(H,27,29)