4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-2-methyl-3-sulfanylidene-pyrrolidine-1-carboxylic acid

Systemtic Name: 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-2-methyl-3-sulfanylidene-pyrrolidine-1-carboxylic acid Openeye Name: 4-[3-(1,3-dioxoisoindolin-2-yl)butyl]-2-methyl-3-thioxo-pyrrolidine-1-carboxylic acid CAS Name: 4-[3-(1,3-dioxo-2-isoindolyl)butyl]-2-methyl-3-sulfanylidene-1-pyrrolidinecarboxylic acid IUPAC Name: 4-[3-(1,3-dioxoisoindol-2-yl)butyl]-2-methyl-3-sulfanylidenepyrrolidine-1-carboxylic acid Traditional Name: 2-methyl-4-(3-phthalimidobutyl)-3-thioxo-pyrrolidine-1-carboxylic acid Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)C(CN1C(=O)O)CCC(C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1C(=S)C(CN1C(=O)O)CCC(C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H20N2O4S/c1-10(7-8-12-9-19(18(23)24)11(2)15(12)25)20-16(21)13-5-3-4-6-14(13)17(20)22/h3-6,10-12H,7-9H2,1-2H3,(H,23,24)