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

Systemtic Name: tert-butyl N-[(2S)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-1-sulfanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-(1,3-dioxoisoindolin-2-yl)-2-thioxo-ethyl]carbamate CAS Name: N-[(2S)-1-(1,3-dioxo-2-isoindolyl)-3-phenyl-1-sulfanylidenepropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(1,3-dioxoisoindol-2-yl)-3-phenyl-1-sulfanylidenepropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-phthalimido-2-thioxo-ethyl]carbamic acid tert-butyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=S)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=S)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H22N2O4S/c1-22(2,3)28-21(27)23-17(13-14-9-5-4-6-10-14)20(29)24-18(25)15-11-7-8-12-16(15)19(24)26/h4-12,17H,13H2,1-3H3,(H,23,27)/t17-/m0/s1