5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one

Systemtic Name: 5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one Openeye Name: 5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one CAS Name: 5-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-1,3-dimethyl-6-nitro-2-benzimidazolone IUPAC Name: 5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one Traditional Name: 5-[4-(4-tert-butylphenyl)sulfonylpiperazino]-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C23H29N5O5S MolecularWeight: 487.57186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)N4C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)N4C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O5S/c1-23(2,3)16-6-8-17(9-7-16)34(32,33)27-12-10-26(11-13-27)20-14-18-19(15-21(20)28(30)31)25(5)22(29)24(18)4/h6-9,14-15H,10-13H2,1-5H3