(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 1,3-benzothiazole-6-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C13H13N5O2S MolecularWeight: 303.33962

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C13H13N5O2S/c1-2-5-18-12(15-16-17-18)7-20-13(19)9-3-4-10-11(6-9)21-8-14-10/h3-4,6,8H,2,5,7H2,1H3