1,3-dimethyl-5-(4-methylsulfonylpiperazin-1-yl)-6-nitro-benzimidazol-2-one

Systemtic Name: 1,3-dimethyl-5-(4-methylsulfonylpiperazin-1-yl)-6-nitro-benzimidazol-2-one Openeye Name: 1,3-dimethyl-5-(4-methylsulfonylpiperazin-1-yl)-6-nitro-benzimidazol-2-one CAS Name: 1,3-dimethyl-5-(4-methylsulfonyl-1-piperazinyl)-6-nitro-2-benzimidazolone IUPAC Name: 1,3-dimethyl-5-(4-methylsulfonylpiperazin-1-yl)-6-nitrobenzimidazol-2-one Traditional Name: 5-(4-mesylpiperazino)-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C14H19N5O5S MolecularWeight: 369.39616

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C14H19N5O5S/c1-15-10-8-12(17-4-6-18(7-5-17)25(3,23)24)13(19(21)22)9-11(10)16(2)14(15)20/h8-9H,4-7H2,1-3H3