methyl (2R)-2-[1-(3-chlorophenyl)-1,2,3-triazol-4-yl]-N-methyl-pyrrolidine-1-carboximidothioate

Systemtic Name: methyl (2R)-2-[1-(3-chlorophenyl)-1,2,3-triazol-4-yl]-N-methyl-pyrrolidine-1-carboximidothioate Openeye Name: methyl (2R)-2-[1-(3-chlorophenyl)triazol-4-yl]-N-methyl-pyrrolidine-1-carboximidothioate CAS Name: (2R)-2-[1-(3-chlorophenyl)-4-triazolyl]-N-methyl-1-pyrrolidinecarboximidothioic acid methyl ester IUPAC Name: methyl (2R)-2-[1-(3-chlorophenyl)triazol-4-yl]-N-methylpyrrolidine-1-carboximidothioate Traditional Name: (2R)-2-[1-(3-chlorophenyl)triazol-4-yl]-N-methyl-pyrrolidine-1-carboximidothioic acid methyl ester Formula: C15H18ClN5S MolecularWeight: 335.85492

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N1CCCC1C2=CN(N=N2)C3=CC(=CC=C3)Cl)SC

Isomeric SMILES

CN=C(N1CCC[C@@H]1C2=CN(N=N2)C3=CC(=CC=C3)Cl)SC

InChI

InChI=1S/C15H18ClN5S/c1-17-15(22-2)20-8-4-7-14(20)13-10-21(19-18-13)12-6-3-5-11(16)9-12/h3,5-6,9-10,14H,4,7-8H2,1-2H3/t14-/m1/s1