3-tert-butyl-N-[3-(diethylamino)propyl]-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-[3-(diethylamino)propyl]-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-[3-(diethylamino)propyl]pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-[3-(diethylamino)propyl]-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-[3-(diethylamino)propyl]pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-[3-(diethylamino)propyl]pyrazole-4-sulfonamide Formula: C21H34N4O2S MolecularWeight: 406.58526

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNS(=O)(=O)C1=CN(N=C1C(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCN(CC)CCCNS(=O)(=O)C1=CN(N=C1C(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C21H34N4O2S/c1-6-24(7-2)15-11-14-22-28(26,27)19-17-25(23-20(19)21(3,4)5)16-18-12-9-8-10-13-18/h8-10,12-13,17,22H,6-7,11,14-16H2,1-5H3