(2-methoxy-4-methylsulfanyl-phenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (2-methoxy-4-methylsulfanyl-phenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: (2-methoxy-4-methylsulfanyl-phenyl)-(4-tetralin-6-ylsulfonylpiperazin-1-yl)methanone CAS Name: [2-methoxy-4-(methylthio)phenyl]-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-methoxy-4-methylsulfanylphenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: [2-methoxy-4-(methylthio)phenyl]-(4-tetralin-6-ylsulfonylpiperazino)methanone Formula: C23H28N2O4S2 MolecularWeight: 460.60942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C23H28N2O4S2/c1-29-22-16-19(30-2)8-10-21(22)23(26)24-11-13-25(14-12-24)31(27,28)20-9-7-17-5-3-4-6-18(17)15-20/h7-10,15-16H,3-6,11-14H2,1-2H3