1-[(6-methylpyridin-2-yl)methyl]-4-(4-methylsulfonylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(6-methylpyridin-2-yl)methyl]-4-(4-methylsulfonylphenyl)sulfonyl-piperazine Openeye Name: 1-[(6-methyl-2-pyridyl)methyl]-4-(4-methylsulfonylphenyl)sulfonyl-piperazine CAS Name: 1-[(6-methyl-2-pyridinyl)methyl]-4-(4-methylsulfonylphenyl)sulfonylpiperazine IUPAC Name: 1-[(6-methylpyridin-2-yl)methyl]-4-(4-methylsulfonylphenyl)sulfonylpiperazine Traditional Name: 1-(4-mesylphenyl)sulfonyl-4-[(6-methyl-2-pyridyl)methyl]piperazine Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H23N3O4S2/c1-15-4-3-5-16(19-15)14-20-10-12-21(13-11-20)27(24,25)18-8-6-17(7-9-18)26(2,22)23/h3-9H,10-14H2,1-2H3