1-(2,5-dimethylphenyl)-4-pyridin-3-ylsulfonyl-piperazine

Systemtic Name: 1-(2,5-dimethylphenyl)-4-pyridin-3-ylsulfonyl-piperazine Openeye Name: 1-(2,5-dimethylphenyl)-4-(3-pyridylsulfonyl)piperazine CAS Name: 1-(2,5-dimethylphenyl)-4-(3-pyridinylsulfonyl)piperazine IUPAC Name: 1-(2,5-dimethylphenyl)-4-pyridin-3-ylsulfonylpiperazine Traditional Name: 1-(2,5-dimethylphenyl)-4-(3-pyridylsulfonyl)piperazine Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2S/c1-14-5-6-15(2)17(12-14)19-8-10-20(11-9-19)23(21,22)16-4-3-7-18-13-16/h3-7,12-13H,8-11H2,1-2H3