S-(1-phenethylpyrrolidin-3-yl) benzenecarbothioate

Systemtic Name: S-(1-phenethylpyrrolidin-3-yl) benzenecarbothioate Openeye Name: S-(1-phenethylpyrrolidin-3-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(1-phenethyl-3-pyrrolidinyl) ester IUPAC Name: S-(1-phenethylpyrrolidin-3-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(1-phenethylpyrrolidin-3-yl) ester Formula: C19H21NOS MolecularWeight: 311.44114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1SC(=O)C2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1SC(=O)C2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H21NOS/c21-19(17-9-5-2-6-10-17)22-18-12-14-20(15-18)13-11-16-7-3-1-4-8-16/h1-10,18H,11-15H2