methyl 3-[methyl-[1-methyl-4-(2-methylpropanoylsulfanyl)pyrrolidin-2-yl]carbonyl-amino]benzoate

Systemtic Name: methyl 3-[methyl-[1-methyl-4-(2-methylpropanoylsulfanyl)pyrrolidin-2-yl]carbonyl-amino]benzoate Openeye Name: methyl 3-[methyl-[1-methyl-4-(2-methylpropanoylsulfanyl)pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 3-[methyl-[[1-methyl-4-[(2-methyl-1-oxopropyl)thio]-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[methyl-[1-methyl-4-(2-methylpropanoylsulfanyl)pyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 3-[[4-(isobutyrylthio)-1-methyl-prolyl]-methyl-amino]benzoic acid methyl ester Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)SC1CC(N(C1)C)C(=O)N(C)C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C)C(=O)SC1CC(N(C1)C)C(=O)N(C)C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C19H26N2O4S/c1-12(2)19(24)26-15-10-16(20(3)11-15)17(22)21(4)14-8-6-7-13(9-14)18(23)25-5/h6-9,12,15-16H,10-11H2,1-5H3