N-cyclopropyl-4-methyl-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-methyl-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-4-methyl-3-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopropyl-4-methyl-3-[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-methyl-3-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopropyl-4-methyl-3-[4-(2-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C21H26N4O3S/c1-16-5-8-19(29(27,28)23-17-6-7-17)14-20(16)21(26)25-12-10-24(11-13-25)15-18-4-2-3-9-22-18/h2-5,8-9,14,17,23H,6-7,10-13,15H2,1H3