3-tert-butyl-1-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-1-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-1-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-1-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-1-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]pyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-1-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]pyrazole-4-sulfonamide Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCCC2=CC(=CC=C2)OC)C3CCCC3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCCC2=CC(=CC=C2)OC)C3CCCC3

InChI

InChI=1S/C21H31N3O3S/c1-21(2,3)20-19(15-24(23-20)17-9-5-6-10-17)28(25,26)22-13-12-16-8-7-11-18(14-16)27-4/h7-8,11,14-15,17,22H,5-6,9-10,12-13H2,1-4H3