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S-(phenylmethyl) 1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carbothioate

S-(phenylmethyl) 1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carbothioate

Systemtic Name:S-(phenylmethyl) 1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carbothioate
Openeye Name:S-benzyl 1-[2-(benzyloxycarbonylamino)acetyl]pyrrolidine-2-carbothioate
CAS Name:1-[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]-2-pyrrolidinecarbothioic acid S-(phenylmethyl) ester
IUPAC Name:S-benzyl 1-[2-(phenylmethoxycarbonylamino)acetyl]pyrrolidine-2-carbothioate
Traditional Name:1-[2-(benzyloxycarbonylamino)acetyl]pyrrolidine-2-carbothioic acid S-benzyl ester
Formula: C22H24N2O4S
MolecularWeight: 412.50196
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNC(=O)OCC2=CC=CC=C2)C(=O)SCC3=CC=CC=C3


Isomeric SMILES

C1CC(N(C1)C(=O)CNC(=O)OCC2=CC=CC=C2)C(=O)SCC3=CC=CC=C3


InChI

InChI=1S/C22H24N2O4S/c25-20(14-23-22(27)28-15-17-8-3-1-4-9-17)24-13-7-12-19(24)21(26)29-16-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16H2,(H,23,27)


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