tert-butyl N-[(2S)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-1-sulfanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-1-sulfanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(1,3-dioxoisoindoline-2-carbothioyl)-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-(1,3-dioxo-2-isoindolyl)-3-methyl-1-sulfanylidenebutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(1,3-dioxoisoindol-2-yl)-3-methyl-1-sulfanylidenebutan-2-yl]carbamate Traditional Name: N-[(1S)-1-(1,3-diketoisoindoline-2-carbothioyl)-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=S)N1C(=O)C2=CC=CC=C2C1=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=S)N1C(=O)C2=CC=CC=C2C1=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H22N2O4S/c1-10(2)13(19-17(23)24-18(3,4)5)16(25)20-14(21)11-8-6-7-9-12(11)15(20)22/h6-10,13H,1-5H3,(H,19,23)/t13-/m0/s1