[2-oxidanylidene-2-(phenylcarbamoylamino)ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(phenylcarbamoylamino)ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate Openeye Name: [2-oxo-2-(phenylcarbamoylamino)ethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate CAS Name: 2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]acetic acid [2-[[anilino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-oxo-2-(phenylcarbamoylamino)ethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate Traditional Name: 2-(pyrrolidine-1-carbothioylthio)acetic acid [2-keto-2-(phenylcarbamoylamino)ethyl] ester Formula: C16H19N3O4S2 MolecularWeight: 381.46976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)OCC(=O)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)OCC(=O)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H19N3O4S2/c20-13(18-15(22)17-12-6-2-1-3-7-12)10-23-14(21)11-25-16(24)19-8-4-5-9-19/h1-3,6-7H,4-5,8-11H2,(H2,17,18,20,22)