[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: (4-indan-5-ylsulfonylpiperazin-1-yl)-(2-methylsulfanylphenyl)methanone CAS Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: (4-indan-5-ylsulfonylpiperazino)-[2-(methylthio)phenyl]methanone Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H24N2O3S2/c1-27-20-8-3-2-7-19(20)21(24)22-11-13-23(14-12-22)28(25,26)18-10-9-16-5-4-6-17(16)15-18/h2-3,7-10,15H,4-6,11-14H2,1H3