6-methyl-5-(2-methylbutyl)-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-5-(2-methylbutyl)-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-5-(2-methylbutyl)-2-[(5-phenyloxazol-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-5-(2-methylbutyl)-2-[(5-phenyl-2-oxazolyl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-5-(2-methylbutyl)-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-5-(2-methylbutyl)-2-[(5-phenyloxazol-2-yl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3=NC=C(O3)C4=CC=CC=C4)C

Isomeric SMILES

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3=NC=C(O3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H23N3O2S2/c1-4-13(2)10-16-14(3)29-21-19(16)20(26)24-22(25-21)28-12-18-23-11-17(27-18)15-8-6-5-7-9-15/h5-9,11,13H,4,10,12H2,1-3H3,(H,24,25,26)