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

Systemtic Name: 2-[(5-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(5-morpholinosulfonyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[[5-(4-morpholinylsulfonyl)-1,3-benzoxazol-2-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(5-morpholin-4-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(5-morpholinosulfonyl-1,3-benzoxazol-2-yl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C18H16N4O5S3 MolecularWeight: 464.53844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C18H16N4O5S3/c23-17-16-12(3-8-28-16)19-15(21-17)10-29-18-20-13-9-11(1-2-14(13)27-18)30(24,25)22-4-6-26-7-5-22/h1-3,8-9H,4-7,10H2,(H,19,21,23)