4-chloranyl-N-[(2S)-3-methyl-1-[4-(2-morpholin-4-ylethanoyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(2S)-3-methyl-1-[4-(2-morpholin-4-ylethanoyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[(1S)-2-methyl-1-[4-(2-morpholinoacetyl)piperazine-1-carbonyl]propyl]benzenesulfonamide CAS Name: 4-chloro-N-[(2S)-3-methyl-1-[4-[2-(4-morpholinyl)-1-oxoethyl]-1-piperazinyl]-1-oxobutan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(2S)-3-methyl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]-1-oxobutan-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-[4-(2-morpholinoacetyl)piperazine-1-carbonyl]propyl]benzenesulfonamide Formula: C21H31ClN4O5S MolecularWeight: 487.01264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C(=O)CN2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C(=O)CN2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H31ClN4O5S/c1-16(2)20(23-32(29,30)18-5-3-17(22)4-6-18)21(28)26-9-7-25(8-10-26)19(27)15-24-11-13-31-14-12-24/h3-6,16,20,23H,7-15H2,1-2H3/t20-/m0/s1