2-[(1-hexylbenzimidazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(1-hexylbenzimidazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1-hexylbenzimidazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(1-hexyl-2-benzimidazolyl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(1-hexylbenzimidazol-2-yl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(1-hexylbenzimidazol-2-yl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H26N4OS2 MolecularWeight: 426.59804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC3=NC4=C(C(=C(S4)C)C)C(=O)N3

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC3=NC4=C(C(=C(S4)C)C)C(=O)N3

InChI

InChI=1S/C22H26N4OS2/c1-4-5-6-9-12-26-17-11-8-7-10-16(17)23-22(26)28-13-18-24-20(27)19-14(2)15(3)29-21(19)25-18/h7-8,10-11H,4-6,9,12-13H2,1-3H3,(H,24,25,27)