prop-2-enyl (2S,4S)-2-[[[2-(hydroxymethyl)pyrrolidin-1-yl]carbothioylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-2-[[[2-(hydroxymethyl)pyrrolidin-1-yl]carbothioylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-2-[[[2-(hydroxymethyl)pyrrolidine-1-carbothioyl]amino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-[[[[2-(hydroxymethyl)-1-pyrrolidinyl]-sulfanylidenemethyl]amino]methyl]-4-mercapto-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-2-[[[2-(hydroxymethyl)pyrrolidine-1-carbothioyl]amino]methyl]-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-4-mercapto-2-[[(2-methylolpyrrolidine-1-carbothioyl)amino]methyl]pyrrolidine-1-carboxylic acid allyl ester Formula: C15H25N3O3S2 MolecularWeight: 359.5073

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1CNC(=S)N2CCCC2CO)S

Isomeric SMILES

C=CCOC(=O)N1C[C@H](C[C@H]1CNC(=S)N2CCCC2CO)S

InChI

InChI=1S/C15H25N3O3S2/c1-2-6-21-15(20)18-9-13(22)7-12(18)8-16-14(23)17-5-3-4-11(17)10-19/h2,11-13,19,22H,1,3-10H2,(H,16,23)/t11?,12-,13-/m0/s1