3-ethyl-5-phenyl-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-5-phenyl-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-5-phenyl-2-[(1-propyltetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-5-phenyl-2-[(1-propyl-5-tetrazolyl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-5-phenyl-2-[(1-propyltetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-5-phenyl-2-[(1-propyltetrazol-5-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C19H20N6OS2 MolecularWeight: 412.5317

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC

InChI

InChI=1S/C19H20N6OS2/c1-3-10-25-15(21-22-23-25)12-28-19-20-17-16(18(26)24(19)4-2)14(11-27-17)13-8-6-5-7-9-13/h5-9,11H,3-4,10,12H2,1-2H3