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

Systemtic Name: (2-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [2-(methylthio)phenyl]-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [2-(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=CC=C3SC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SC

InChI

InChI=1S/C21H26N2O3S2/c1-3-6-17-9-11-18(12-10-17)28(25,26)23-15-13-22(14-16-23)21(24)19-7-4-5-8-20(19)27-2/h4-5,7-12H,3,6,13-16H2,1-2H3