N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[2-methyl-2-(4-methyl-1-piperazinyl)propyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: [2-methyl-2-(4-methylpiperazino)propyl]-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C20H33N5O4S MolecularWeight: 439.57212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-])N3CCN(CC3)C

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-])N3CCN(CC3)C

InChI

InChI=1S/C20H33N5O4S/c1-20(2,23-13-11-22(3)12-14-23)16-21-18-8-7-17(15-19(18)25(26)27)30(28,29)24-9-5-4-6-10-24/h7-8,15,21H,4-6,9-14,16H2,1-3H3