N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]aniline

Systemtic Name: N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]aniline Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline CAS Name: N-methyl-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitro-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]aniline IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroaniline Traditional Name: (1-benzylpyrazol-4-yl)methyl-methyl-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]amine Formula: C23H28N6O4S MolecularWeight: 484.57122

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=CN(N=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=CN(N=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N6O4S/c1-25-10-12-28(13-11-25)34(32,33)21-8-9-22(23(14-21)29(30)31)26(2)16-20-15-24-27(18-20)17-19-6-4-3-5-7-19/h3-9,14-15,18H,10-13,16-17H2,1-2H3