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

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)propyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-[3-(2-ketopyrrolidino)propyl]-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNS(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)CCCNS(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O3S2/c26-20-10-4-12-24(20)13-6-11-22-30(27,28)19-16-25(15-17-7-2-1-3-8-17)23-21(19)18-9-5-14-29-18/h1-3,5,7-9,14,16,22H,4,6,10-13,15H2