2-[[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]amino]-1-(4-nitrophenyl)ethanol

Systemtic Name: 2-[[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]amino]-1-(4-nitrophenyl)ethanol Openeye Name: 2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]amino]-1-(4-nitrophenyl)ethanol CAS Name: 2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]amino]-1-(4-nitrophenyl)ethanol IUPAC Name: 2-[[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]amino]-1-(4-nitrophenyl)ethanol Traditional Name: 2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]amino]-1-(4-nitrophenyl)ethanol Formula: C18H23N5O5S MolecularWeight: 421.47072

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H23N5O5S/c1-21-8-10-22(11-9-21)29(27,28)16-6-7-18(19-12-16)20-13-17(24)14-2-4-15(5-3-14)23(25)26/h2-7,12,17,24H,8-11,13H2,1H3,(H,19,20)