[2,5-bis(oxidanylidene)pyrrolidin-3-yl] (E)-2-ethylsulfanyl-4-phenyl-but-3-enoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-3-yl] (E)-2-ethylsulfanyl-4-phenyl-but-3-enoate Openeye Name: (2,5-dioxopyrrolidin-3-yl) (E)-2-ethylsulfanyl-4-phenyl-but-3-enoate CAS Name: (E)-2-(ethylthio)-4-phenyl-3-butenoic acid (2,5-dioxo-3-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-3-yl) (E)-2-ethylsulfanyl-4-phenylbut-3-enoate Traditional Name: (E)-2-(ethylthio)-4-phenyl-but-3-enoic acid (2,5-diketopyrrolidin-3-yl) ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C=CC1=CC=CC=C1)C(=O)OC2CC(=O)NC2=O

Isomeric SMILES

CCSC(/C=C/C1=CC=CC=C1)C(=O)OC2CC(=O)NC2=O

InChI

InChI=1S/C16H17NO4S/c1-2-22-13(9-8-11-6-4-3-5-7-11)16(20)21-12-10-14(18)17-15(12)19/h3-9,12-13H,2,10H2,1H3,(H,17,18,19)/b9-8+