prop-2-enyl 2-(2-azanyl-2-azanylidene-ethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate hydrochloride

Systemtic Name: prop-2-enyl 2-(2-azanyl-2-azanylidene-ethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate hydrochloride Openeye Name: allyl 2-(2-amino-2-imino-ethyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate hydrochloride CAS Name: 2-(2-amino-2-iminoethyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester hydrochloride IUPAC Name: prop-2-enyl 2-(2-amino-2-iminoethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate hydrochloride Traditional Name: 2-(2-amino-2-imino-ethyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester hydrochloride Formula: C29H32ClN3O2S MolecularWeight: 522.10128

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1CC(=N)N)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C=CCOC(=O)N1CC(CC1CC(=N)N)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C29H31N3O2S.ClH/c1-2-18-34-28(33)32-21-26(19-25(32)20-27(30)31)35-29(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24;/h2-17,25-26H,1,18-21H2,(H3,30,31);1H