5-[(5-methyl-4-phenyl-1,2,3-triazol-1-yl)methyl]-1-methylsulfonyl-pyrrolidine-3-thiol

Systemtic Name: 5-[(5-methyl-4-phenyl-1,2,3-triazol-1-yl)methyl]-1-methylsulfonyl-pyrrolidine-3-thiol Openeye Name: 5-[(5-methyl-4-phenyl-triazol-1-yl)methyl]-1-methylsulfonyl-pyrrolidine-3-thiol CAS Name: 5-[(5-methyl-4-phenyl-1-triazolyl)methyl]-1-methylsulfonyl-3-pyrrolidinethiol IUPAC Name: 5-[(5-methyl-4-phenyltriazol-1-yl)methyl]-1-methylsulfonylpyrrolidine-3-thiol Traditional Name: 1-mesyl-5-[(5-methyl-4-phenyl-triazol-1-yl)methyl]pyrrolidine-3-thiol Formula: C15H20N4O2S2 MolecularWeight: 352.4749

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1CC2CC(CN2S(=O)(=O)C)S)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=NN1CC2CC(CN2S(=O)(=O)C)S)C3=CC=CC=C3

InChI

InChI=1S/C15H20N4O2S2/c1-11-15(12-6-4-3-5-7-12)16-17-18(11)9-13-8-14(22)10-19(13)23(2,20)21/h3-7,13-14,22H,8-10H2,1-2H3