5,6-dimethyl-1-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]benzimidazole

Systemtic Name: 5,6-dimethyl-1-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]benzimidazole Openeye Name: 5,6-dimethyl-1-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]benzimidazole CAS Name: 5,6-dimethyl-1-[4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitrophenyl]benzimidazole IUPAC Name: 5,6-dimethyl-1-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitrophenyl]benzimidazole Traditional Name: 5,6-dimethyl-1-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]benzimidazole Formula: C20H23N5O4S MolecularWeight: 429.49272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C3=C(C=C(C=C3)S(=O)(=O)N4CCN(CC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)C3=C(C=C(C=C3)S(=O)(=O)N4CCN(CC4)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4S/c1-14-10-17-19(11-15(14)2)24(13-21-17)18-5-4-16(12-20(18)25(26)27)30(28,29)23-8-6-22(3)7-9-23/h4-5,10-13H,6-9H2,1-3H3