N-[2-(2,6-dimethylmorpholin-4-yl)-2-methyl-propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[2-(2,6-dimethylmorpholin-4-yl)-2-methyl-propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[2-(2,6-dimethylmorpholin-4-yl)-2-methyl-propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline CAS Name: N-[2-(2,6-dimethyl-4-morpholinyl)-2-methylpropyl]-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [2-(2,6-dimethylmorpholino)-2-methyl-propyl]-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]amine Formula: C21H35N5O5S MolecularWeight: 469.5981

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(C)(C)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C(C)(C)CNC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H35N5O5S/c1-16-13-24(14-17(2)31-16)21(3,4)15-22-19-7-6-18(12-20(19)26(27)28)32(29,30)25-10-8-23(5)9-11-25/h6-7,12,16-17,22H,8-11,13-15H2,1-5H3