1-(1,3-benzothiazol-2-ylmethyl)-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-(2-thienyl)tetrazol-5-one CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-(2-thienyl)tetrazol-5-one Formula: C13H9N5OS2 MolecularWeight: 315.37346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C13H9N5OS2/c19-13-17(15-16-18(13)12-6-3-7-20-12)8-11-14-9-4-1-2-5-10(9)21-11/h1-7H,8H2