N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-2-(p-tolylsulfonyl)acetamide CAS Name: N-[4-(4-cyclohexyl-1-piperazinyl)phenyl]-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-[4-(4-cyclohexylpiperazino)phenyl]-2-tosyl-acetamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-20-7-13-24(14-8-20)32(30,31)19-25(29)26-21-9-11-23(12-10-21)28-17-15-27(16-18-28)22-5-3-2-4-6-22/h7-14,22H,2-6,15-19H2,1H3,(H,26,29)