N-(2-methylsulfanylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)acetamide CAS Name: N-[2-(methylthio)phenyl]-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[2-(methylthio)phenyl]-2-(4-p-cumenylsulfonylpiperazino)acetamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C22H29N3O3S2/c1-17(2)18-8-10-19(11-9-18)30(27,28)25-14-12-24(13-15-25)16-22(26)23-20-6-4-5-7-21(20)29-3/h4-11,17H,12-16H2,1-3H3,(H,23,26)