1-(4-methyl-3-nitro-phenyl)sulfonyl-4-[(6-methylpyridin-2-yl)methyl]piperazine

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)sulfonyl-4-[(6-methylpyridin-2-yl)methyl]piperazine Openeye Name: 1-(4-methyl-3-nitro-phenyl)sulfonyl-4-[(6-methyl-2-pyridyl)methyl]piperazine CAS Name: 1-(4-methyl-3-nitrophenyl)sulfonyl-4-[(6-methyl-2-pyridinyl)methyl]piperazine IUPAC Name: 1-(4-methyl-3-nitrophenyl)sulfonyl-4-[(6-methylpyridin-2-yl)methyl]piperazine Traditional Name: 1-(4-methyl-3-nitro-phenyl)sulfonyl-4-[(6-methyl-2-pyridyl)methyl]piperazine Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4S/c1-14-6-7-17(12-18(14)22(23)24)27(25,26)21-10-8-20(9-11-21)13-16-5-3-4-15(2)19-16/h3-7,12H,8-11,13H2,1-2H3