N-(4-ethylphenyl)-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-(4-ethylphenyl)-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-(4-ethylphenyl)-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline CAS Name: N-(4-ethylphenyl)-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-(4-ethylphenyl)-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroaniline Traditional Name: (4-ethylphenyl)-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]amine Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O4S/c1-3-15-4-6-16(7-5-15)20-18-9-8-17(14-19(18)23(24)25)28(26,27)22-12-10-21(2)11-13-22/h4-9,14,20H,3,10-13H2,1-2H3