4-chloranyl-N-propan-2-yl-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-propan-2-yl-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N-isopropyl-3-(4-pyrrolidin-1-ylsulfonylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: 4-chloro-3-[oxo-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-chloro-N-propan-2-yl-3-(4-pyrrolidin-1-ylsulfonylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: 4-chloro-N-isopropyl-3-(4-pyrrolidinosulfonylpiperazine-1-carbonyl)benzenesulfonamide Formula: C18H27ClN4O5S2 MolecularWeight: 479.01378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H27ClN4O5S2/c1-14(2)20-29(25,26)15-5-6-17(19)16(13-15)18(24)21-9-11-23(12-10-21)30(27,28)22-7-3-4-8-22/h5-6,13-14,20H,3-4,7-12H2,1-2H3