methyl 1-(3-oxidanylidene-3-phenyl-propyl)sulfanylcarbothioylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(3-oxidanylidene-3-phenyl-propyl)sulfanylcarbothioylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(3-oxo-3-phenyl-propyl)sulfanylcarbothioylpyrrolidine-2-carboxylate CAS Name: 1-[[(3-oxo-3-phenylpropyl)thio]-sulfanylidenemethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-oxo-3-phenylpropyl)sulfanylcarbothioylpyrrolidine-2-carboxylate Traditional Name: 1-[(3-keto-3-phenyl-propyl)thio]carbothioylpyrrolidine-2-carboxylic acid methyl ester Formula: C16H19NO3S2 MolecularWeight: 337.45696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=S)SCCC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CCCN1C(=S)SCCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H19NO3S2/c1-20-15(19)13-8-5-10-17(13)16(21)22-11-9-14(18)12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-11H2,1H3