N-[(1R)-2-(4-butanoylpiperazin-1-yl)-1-(4-chlorophenyl)sulfonyl-2-oxidanylidene-ethyl]-4-methyl-benzamide

Systemtic Name: N-[(1R)-2-(4-butanoylpiperazin-1-yl)-1-(4-chlorophenyl)sulfonyl-2-oxidanylidene-ethyl]-4-methyl-benzamide Openeye Name: N-[(1R)-2-(4-butanoylpiperazin-1-yl)-1-(4-chlorophenyl)sulfonyl-2-oxo-ethyl]-4-methyl-benzamide CAS Name: N-[(1R)-1-(4-chlorophenyl)sulfonyl-2-oxo-2-[4-(1-oxobutyl)-1-piperazinyl]ethyl]-4-methylbenzamide IUPAC Name: N-[(1R)-2-(4-butanoylpiperazin-1-yl)-1-(4-chlorophenyl)sulfonyl-2-oxoethyl]-4-methylbenzamide Traditional Name: N-[(1R)-2-(4-butyrylpiperazino)-1-(4-chlorophenyl)sulfonyl-2-keto-ethyl]-4-methyl-benzamide Formula: C24H28ClN3O5S MolecularWeight: 506.01422

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C(=O)[C@H](NC(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H28ClN3O5S/c1-3-4-21(29)27-13-15-28(16-14-27)24(31)23(26-22(30)18-7-5-17(2)6-8-18)34(32,33)20-11-9-19(25)10-12-20/h5-12,23H,3-4,13-16H2,1-2H3,(H,26,30)/t23-/m1/s1