3-azanyl-4-methyl-3-(2-methylpropyl)-2-oxidanyl-2-phenyl-5-(2-pyridin-3-ylethyl)piperazine-1-sulfonamide

Systemtic Name: 3-azanyl-4-methyl-3-(2-methylpropyl)-2-oxidanyl-2-phenyl-5-(2-pyridin-3-ylethyl)piperazine-1-sulfonamide Openeye Name: 3-amino-2-hydroxy-3-isobutyl-4-methyl-2-phenyl-5-[2-(3-pyridyl)ethyl]piperazine-1-sulfonamide CAS Name: 3-amino-2-hydroxy-4-methyl-3-(2-methylpropyl)-2-phenyl-5-[2-(3-pyridinyl)ethyl]-1-piperazinesulfonamide IUPAC Name: 3-amino-2-hydroxy-4-methyl-3-(2-methylpropyl)-2-phenyl-5-(2-pyridin-3-ylethyl)piperazine-1-sulfonamide Traditional Name: 3-amino-2-hydroxy-3-isobutyl-4-methyl-2-phenyl-5-[2-(3-pyridyl)ethyl]piperazine-1-sulfonamide Formula: C22H33N5O3S MolecularWeight: 447.59412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C(N(CC(N1C)CCC2=CN=CC=C2)S(=O)(=O)N)(C3=CC=CC=C3)O)N

Isomeric SMILES

CC(C)CC1(C(N(CC(N1C)CCC2=CN=CC=C2)S(=O)(=O)N)(C3=CC=CC=C3)O)N

InChI

InChI=1S/C22H33N5O3S/c1-17(2)14-21(23)22(28,19-9-5-4-6-10-19)27(31(24,29)30)16-20(26(21)3)12-11-18-8-7-13-25-15-18/h4-10,13,15,17,20,28H,11-12,14,16,23H2,1-3H3,(H2,24,29,30)