(4-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(methylthio)phenyl]-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(methylthio)phenyl]-[4-(4-propylphenyl)sulfonylpiperazino]methanone Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H26N2O3S2/c1-3-4-17-5-11-20(12-6-17)28(25,26)23-15-13-22(14-16-23)21(24)18-7-9-19(27-2)10-8-18/h5-12H,3-4,13-16H2,1-2H3