N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1S)-2-methyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]propyl]cyclohexanecarboxamide CAS Name: N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxobutan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxobutan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1S)-2-methyl-1-(4-tosylpiperazine-1-carbonyl)propyl]cyclohexanecarboxamide Formula: C23H35N3O4S MolecularWeight: 449.6067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)[C@H](C(C)C)NC(=O)C3CCCCC3

InChI

InChI=1S/C23H35N3O4S/c1-17(2)21(24-22(27)19-7-5-4-6-8-19)23(28)25-13-15-26(16-14-25)31(29,30)20-11-9-18(3)10-12-20/h9-12,17,19,21H,4-8,13-16H2,1-3H3,(H,24,27)/t21-/m0/s1