(3-methylphenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-methylphenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: m-tolyl-(4-tetralin-6-ylsulfonylpiperazin-1-yl)methanone CAS Name: (3-methylphenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-methylphenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: m-tolyl-(4-tetralin-6-ylsulfonylpiperazino)methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C22H26N2O3S/c1-17-5-4-8-20(15-17)22(25)23-11-13-24(14-12-23)28(26,27)21-10-9-18-6-2-3-7-19(18)16-21/h4-5,8-10,15-16H,2-3,6-7,11-14H2,1H3