(phenylmethyl) 1-(2-azanyl-4-methylsulfanyl-butanoyl)pyrrolidine-2-carboxylate hydrochloride

Systemtic Name: (phenylmethyl) 1-(2-azanyl-4-methylsulfanyl-butanoyl)pyrrolidine-2-carboxylate hydrochloride Openeye Name: benzyl 1-(2-amino-4-methylsulfanyl-butanoyl)pyrrolidine-2-carboxylate hydrochloride CAS Name: 1-[2-amino-4-(methylthio)-1-oxobutyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 1-(2-amino-4-methylsulfanylbutanoyl)pyrrolidine-2-carboxylate hydrochloride Traditional Name: 1-[2-amino-4-(methylthio)butanoyl]pyrrolidine-2-carboxylic acid benzyl ester hydrochloride Formula: C17H25ClN2O3S MolecularWeight: 372.91

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)N.Cl

Isomeric SMILES

CSCCC(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)N.Cl

InChI

InChI=1S/C17H24N2O3S.ClH/c1-23-11-9-14(18)16(20)19-10-5-8-15(19)17(21)22-12-13-6-3-2-4-7-13;/h2-4,6-7,14-15H,5,8-12,18H2,1H3;1H