prop-2-enyl (2S,4S)-2-(2-hydroxyethylcarbamoyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-2-(2-hydroxyethylcarbamoyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-2-(2-hydroxyethylcarbamoyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-[(2-hydroxyethylamino)-oxomethyl]-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-2-(2-hydroxyethylcarbamoyl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-(2-hydroxyethylcarbamoyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C30H32N2O4S MolecularWeight: 516.65108

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1C(=O)NCCO)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C=CCOC(=O)N1C[C@H](C[C@H]1C(=O)NCCO)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H32N2O4S/c1-2-20-36-29(35)32-22-26(21-27(32)28(34)31-18-19-33)37-30(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h2-17,26-27,33H,1,18-22H2,(H,31,34)/t26-,27-/m0/s1