(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-(4-methylphenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 2-(4-methylphenyl)-1,3-thiazole-4-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 2-(p-tolyl)thiazole-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-thiazolecarboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 2-(4-methylphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(p-tolyl)thiazole-4-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)C

InChI

InChI=1S/C17H19N5O2S/c1-3-4-9-22-15(19-20-21-22)10-24-17(23)14-11-25-16(18-14)13-7-5-12(2)6-8-13/h5-8,11H,3-4,9-10H2,1-2H3