S-phenethyl 1-(phenylsulfonyl)pyrrolidine-2-carbothioate

Systemtic Name: S-phenethyl 1-(phenylsulfonyl)pyrrolidine-2-carbothioate Openeye Name: S-phenethyl 1-(benzenesulfonyl)pyrrolidine-2-carbothioate CAS Name: 1-(benzenesulfonyl)-2-pyrrolidinecarbothioic acid S-phenethyl ester IUPAC Name: S-phenethyl 1-(benzenesulfonyl)pyrrolidine-2-carbothioate Traditional Name: 1-besylpyrrolidine-2-carbothioic acid S-phenethyl ester Formula: C19H21NO3S2 MolecularWeight: 375.50494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)SCCC3=CC=CC=C3

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)SCCC3=CC=CC=C3

InChI

InChI=1S/C19H21NO3S2/c21-19(24-15-13-16-8-3-1-4-9-16)18-12-7-14-20(18)25(22,23)17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2