4-[2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-1-propyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-1-propylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C20H26N6O5S MolecularWeight: 462.52264

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4C(=C(C(=N4)C)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4C(=C(C(=N4)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H26N6O5S/c1-4-7-24-18-6-5-16(32(29,30)23-8-10-31-11-9-23)12-17(18)21-19(24)13-25-15(3)20(26(27)28)14(2)22-25/h5-6,12H,4,7-11,13H2,1-3H3