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

Systemtic Name: 3-phenyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-phenyl-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-phenyl-2-[(1-phenyl-5-tetrazolyl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-phenyl-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-phenyl-2-[(1-phenyltetrazol-5-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C20H14N6OS2 MolecularWeight: 418.49476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)CSC3=NC4=C(C=CS4)C(=O)N3C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)CSC3=NC4=C(C=CS4)C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C20H14N6OS2/c27-19-16-11-12-28-18(16)21-20(25(19)14-7-3-1-4-8-14)29-13-17-22-23-24-26(17)15-9-5-2-6-10-15/h1-12H,13H2