2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylthio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=N1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC=C

Isomeric SMILES

CC(C)(C)C1=NOC(=N1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC=C

InChI

InChI=1S/C22H22N4O2S2/c1-5-11-26-19(27)17-15(14-9-7-6-8-10-14)12-29-18(17)24-21(26)30-13-16-23-20(25-28-16)22(2,3)4/h5-10,12H,1,11,13H2,2-4H3