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

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(1-methyl-5-tetrazolyl)thio]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(1-methyltetrazol-5-yl)thio]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C15H12N6OS2 MolecularWeight: 356.42538

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CN1C(=NN=N1)SCC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C15H12N6OS2/c1-21-15(18-19-20-21)23-8-12-16-13(22)10-7-11(24-14(10)17-12)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,16,17,22)