prop-2-enyl 5-[(E)-2-[(2S,4S)-1-but-3-enoyl-4-sulfanyl-pyrrolidin-2-yl]ethenyl]-1,2-oxazole-3-carboxylate

Systemtic Name: prop-2-enyl 5-[(E)-2-[(2S,4S)-1-but-3-enoyl-4-sulfanyl-pyrrolidin-2-yl]ethenyl]-1,2-oxazole-3-carboxylate Openeye Name: allyl 5-[(E)-2-[(2S,4S)-1-but-3-enoyl-4-sulfanyl-pyrrolidin-2-yl]vinyl]isoxazole-3-carboxylate CAS Name: 5-[(E)-2-[(2S,4S)-4-mercapto-1-(1-oxobut-3-enyl)-2-pyrrolidinyl]ethenyl]-3-isoxazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-[(E)-2-[(2S,4S)-1-but-3-enoyl-4-sulfanylpyrrolidin-2-yl]ethenyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[(E)-2-[(2S,4S)-1-but-3-enoyl-4-mercapto-pyrrolidin-2-yl]vinyl]isoxazole-3-carboxylic acid allyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=O)N1CC(CC1C=CC2=CC(=NO2)C(=O)OCC=C)S

Isomeric SMILES

C=CCC(=O)N1C[C@H](C[C@H]1/C=C/C2=CC(=NO2)C(=O)OCC=C)S

InChI

InChI=1S/C17H20N2O4S/c1-3-5-16(20)19-11-14(24)9-12(19)6-7-13-10-15(18-23-13)17(21)22-8-4-2/h3-4,6-7,10,12,14,24H,1-2,5,8-9,11H2/b7-6+/t12-,14+/m1/s1