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

Systemtic Name: methyl (2R)-2-[2-(4-cyanophenyl)-1,2,3,4-tetrazol-5-yl]-N-methyl-piperidine-1-carboximidothioate Openeye Name: methyl (2R)-2-[2-(4-cyanophenyl)tetrazol-5-yl]-N-methyl-piperidine-1-carboximidothioate CAS Name: (2R)-2-[2-(4-cyanophenyl)-5-tetrazolyl]-N-methyl-1-piperidinecarboximidothioic acid methyl ester IUPAC Name: methyl (2R)-2-[2-(4-cyanophenyl)tetrazol-5-yl]-N-methylpiperidine-1-carboximidothioate Traditional Name: (2R)-2-[2-(4-cyanophenyl)tetrazol-5-yl]-N-methyl-piperidine-1-carboximidothioic acid methyl ester Formula: C16H19N7S MolecularWeight: 341.43396

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N1CCCCC1C2=NN(N=N2)C3=CC=C(C=C3)C#N)SC

Isomeric SMILES

CN=C(N1CCCC[C@@H]1C2=NN(N=N2)C3=CC=C(C=C3)C#N)SC

InChI

InChI=1S/C16H19N7S/c1-18-16(24-2)22-10-4-3-5-14(22)15-19-21-23(20-15)13-8-6-12(11-17)7-9-13/h6-9,14H,3-5,10H2,1-2H3/t14-/m1/s1