prop-2-enyl (2S,4S)-2-[(Z)-3-(dimethylamino)prop-1-enyl]-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-2-[(Z)-3-(dimethylamino)prop-1-enyl]-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-2-[(Z)-3-(dimethylamino)prop-1-enyl]-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-[(Z)-3-(dimethylamino)prop-1-enyl]-4-mercapto-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-2-[(Z)-3-(dimethylamino)prop-1-enyl]-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-[(Z)-3-(dimethylamino)prop-1-enyl]-4-mercapto-pyrrolidine-1-carboxylic acid allyl ester Formula: C13H22N2O2S MolecularWeight: 270.39098

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC=CC1CC(CN1C(=O)OCC=C)S

Isomeric SMILES

CN(C)C/C=C\[C@@H]1C[C@@H](CN1C(=O)OCC=C)S

InChI

InChI=1S/C13H22N2O2S/c1-4-8-17-13(16)15-10-12(18)9-11(15)6-5-7-14(2)3/h4-6,11-12,18H,1,7-10H2,2-3H3/b6-5-/t11-,12+/m1/s1