3-chloranyl-N-[2-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[2-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Openeye Name: 3-chloro-N-[2-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]ethyl]benzenesulfonamide CAS Name: 3-chloro-N-[2-[[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]ethyl]benzenesulfonamide IUPAC Name: 3-chloro-N-[2-[(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl]benzenesulfonamide Traditional Name: 3-chloro-N-[2-[(2-methyl-6-pyrrolidino-pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Formula: C17H22ClN5O2S MolecularWeight: 395.90688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NCCNS(=O)(=O)C2=CC(=CC=C2)Cl)N3CCCC3

Isomeric SMILES

CC1=NC(=CC(=N1)NCCNS(=O)(=O)C2=CC(=CC=C2)Cl)N3CCCC3

InChI

InChI=1S/C17H22ClN5O2S/c1-13-21-16(12-17(22-13)23-9-2-3-10-23)19-7-8-20-26(24,25)15-6-4-5-14(18)11-15/h4-6,11-12,20H,2-3,7-10H2,1H3,(H,19,21,22)