3-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-[(3-morpholinosulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[[3-(4-morpholinylsulfonyl)phenyl]methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-methyl-2-[(3-morpholinosulfonylbenzyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C18H19N3O4S3 MolecularWeight: 437.55616

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)SC=C2

InChI

InChI=1S/C18H19N3O4S3/c1-20-17(22)15-5-10-26-16(15)19-18(20)27-12-13-3-2-4-14(11-13)28(23,24)21-6-8-25-9-7-21/h2-5,10-11H,6-9,12H2,1H3