N-[[1,3-bis(oxidanylidene)isoindol-4-yl]carbamothioyl]-4-tert-butyl-benzamide

Systemtic Name: N-[[1,3-bis(oxidanylidene)isoindol-4-yl]carbamothioyl]-4-tert-butyl-benzamide Openeye Name: 4-tert-butyl-N-[(1,3-dioxoisoindolin-4-yl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(1,3-dioxo-4-isoindolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(1,3-dioxoisoindol-4-yl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(1,3-diketoisoindolin-4-yl)thiocarbamoyl]benzamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2C(=O)NC3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2C(=O)NC3=O

InChI

InChI=1S/C20H19N3O3S/c1-20(2,3)12-9-7-11(8-10-12)16(24)23-19(27)21-14-6-4-5-13-15(14)18(26)22-17(13)25/h4-10H,1-3H3,(H,22,25,26)(H2,21,23,24,27)