2-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C20H21N5O4S3 MolecularWeight: 491.60684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C20H21N5O4S3/c1-2-25-16-4-3-13(32(27,28)24-6-8-29-9-7-24)11-15(16)22-20(25)31-12-17-21-14-5-10-30-18(14)19(26)23-17/h3-5,10-11H,2,6-9,12H2,1H3,(H,21,23,26)