3-tert-butyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-[3-(2-ketopyrrolidino)propyl]pyrazole-4-sulfonamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCCCN2CCCC2=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)NCCCN2CCCC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H30N4O3S/c1-21(2,3)20-18(16-25(23-20)15-17-9-5-4-6-10-17)29(27,28)22-12-8-14-24-13-7-11-19(24)26/h4-6,9-10,16,22H,7-8,11-15H2,1-3H3