methyl 2-[2-(3-cyanophenyl)-1,2,3,4-tetrazol-5-yl]-N-methyl-pyrrolidine-1-carboximidothioate

Systemtic Name: methyl 2-[2-(3-cyanophenyl)-1,2,3,4-tetrazol-5-yl]-N-methyl-pyrrolidine-1-carboximidothioate Openeye Name: methyl 2-[2-(3-cyanophenyl)tetrazol-5-yl]-N-methyl-pyrrolidine-1-carboximidothioate CAS Name: 2-[2-(3-cyanophenyl)-5-tetrazolyl]-N-methyl-1-pyrrolidinecarboximidothioic acid methyl ester IUPAC Name: methyl 2-[2-(3-cyanophenyl)tetrazol-5-yl]-N-methylpyrrolidine-1-carboximidothioate Traditional Name: 2-[2-(3-cyanophenyl)tetrazol-5-yl]-N-methyl-pyrrolidine-1-carboximidothioic acid methyl ester Formula: C15H17N7S MolecularWeight: 327.40738

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N1CCCC1C2=NN(N=N2)C3=CC=CC(=C3)C#N)SC

Isomeric SMILES

CN=C(N1CCCC1C2=NN(N=N2)C3=CC=CC(=C3)C#N)SC

InChI

InChI=1S/C15H17N7S/c1-17-15(23-2)21-8-4-7-13(21)14-18-20-22(19-14)12-6-3-5-11(9-12)10-16/h3,5-6,9,13H,4,7-8H2,1-2H3