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

Systemtic Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-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]thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-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]thieno[2,3-d]pyrimidin-4-one Formula: C16H18N4O2S2 MolecularWeight: 362.46972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O2S2/c1-5-7-20-13(21)10-6-8-23-12(10)18-15(20)24-9-11-17-14(19-22-11)16(2,3)4/h5-6,8H,1,7,9H2,2-4H3