N,N,2,3-tetramethyl-5-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N,N,2,3-tetramethyl-5-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N,N,2,3-tetramethyl-5-[4-(4-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N,N,2,3-tetramethyl-5-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N,N,2,3-tetramethyl-5-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N,N,2,3-tetramethyl-5-[4-(4-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=NC=C3)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=NC=C3)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C21H28N4O3S/c1-16-13-19(14-20(17(16)2)29(27,28)23(3)4)21(26)25-11-9-24(10-12-25)15-18-5-7-22-8-6-18/h5-8,13-14H,9-12,15H2,1-4H3