prop-2-enyl 2-(5-oxidanylidenepyrazolidin-3-yl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-(5-oxidanylidenepyrazolidin-3-yl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl 2-(5-oxopyrazolidin-3-yl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-(5-oxo-3-pyrazolidinyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(5-oxopyrazolidin-3-yl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(5-ketopyrazolidin-3-yl)-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C30H31N3O3S MolecularWeight: 513.65044

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1C2CC(=O)NN2)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CCOC(=O)N1CC(CC1C2CC(=O)NN2)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H31N3O3S/c1-2-18-36-29(35)33-21-25(19-27(33)26-20-28(34)32-31-26)37-30(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h2-17,25-27,31H,1,18-21H2,(H,32,34)