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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[5-(3-thienyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-thiophenyl)-2-tetrazolyl]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(5-thiophen-3-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(3-thienyl)tetrazol-2-yl]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C15H11N5O2S2 MolecularWeight: 357.41014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)CN3N=C(N=N3)C4=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)CN3N=C(N=N3)C4=CSC=C4

InChI

InChI=1S/C15H11N5O2S2/c21-14(7-20-18-15(17-19-20)10-5-6-23-9-10)22-8-13-16-11-3-1-2-4-12(11)24-13/h1-6,9H,7-8H2