(2-methyl-1,3-thiazol-4-yl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (2-methyl-1,3-thiazol-4-yl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (2-methylthiazol-4-yl)methyl 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid (2-methyl-4-thiazolyl)methyl ester IUPAC Name: (2-methyl-1,3-thiazol-4-yl)methyl 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid (2-methylthiazol-4-yl)methyl ester Formula: C13H11N5O2S MolecularWeight: 301.32374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

CC1=NC(=CS1)COC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C13H11N5O2S/c1-9-15-11(7-21-9)6-20-13(19)10-2-4-12(5-3-10)18-8-14-16-17-18/h2-5,7-8H,6H2,1H3