prop-2-enyl 2-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl 2-[(E)-3-amino-3-oxo-prop-1-enyl]-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-[(E)-3-amino-3-oxoprop-1-enyl]-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[(E)-3-amino-3-oxoprop-1-enyl]-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-[(E)-3-amino-3-keto-prop-1-enyl]-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C30H30N2O3S MolecularWeight: 498.6358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C=CCOC(=O)N1CC(CC1/C=C/C(=O)N)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H30N2O3S/c1-2-20-35-29(34)32-22-27(21-26(32)18-19-28(31)33)36-30(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h2-19,26-27H,1,20-22H2,(H2,31,33)/b19-18+