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

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1-cyclopentyltetrazol-5-yl)sulfanylmethyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(1-cyclopentyl-5-tetrazolyl)thio]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(1-cyclopentyltetrazol-5-yl)sulfanylmethyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(1-cyclopentyltetrazol-5-yl)thio]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H18N6OS2 MolecularWeight: 410.51582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCC3=NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N3

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SCC3=NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N3

InChI

InChI=1S/C19H18N6OS2/c26-17-14-10-15(12-6-2-1-3-7-12)28-18(14)21-16(20-17)11-27-19-22-23-24-25(19)13-8-4-5-9-13/h1-3,6-7,10,13H,4-5,8-9,11H2,(H,20,21,26)