4-[2-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[[(2,6-dimethyl-4-pyrimidinyl)thio]methyl]-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[[(2,6-dimethylpyrimidin-4-yl)thio]methyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C20H25N5O3S2 MolecularWeight: 447.5742

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC(=NC(=C4)C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC(=NC(=C4)C)C

InChI

InChI=1S/C20H25N5O3S2/c1-4-25-18-6-5-16(30(26,27)24-7-9-28-10-8-24)12-17(18)23-19(25)13-29-20-11-14(2)21-15(3)22-20/h5-6,11-12H,4,7-10,13H2,1-3H3