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

Systemtic Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2,5-dimethylphenyl)methanone Openeye Name: (2,5-dimethylphenyl)-(4-indan-5-ylsulfonylpiperazin-1-yl)methanone CAS Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-(2,5-dimethylphenyl)methanone IUPAC Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2,5-dimethylphenyl)methanone Traditional Name: (2,5-dimethylphenyl)-(4-indan-5-ylsulfonylpiperazino)methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H26N2O3S/c1-16-6-7-17(2)21(14-16)22(25)23-10-12-24(13-11-23)28(26,27)20-9-8-18-4-3-5-19(18)15-20/h6-9,14-15H,3-5,10-13H2,1-2H3