N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(1,3-dioxo-2-phenyl-isoindolin-4-yl)carbamothioyl]benzamide CAS Name: N-[[(1,3-dioxo-2-phenyl-4-isoindolyl)amino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(1,3-dioxo-2-phenylisoindol-4-yl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(1,3-diketo-2-phenyl-isoindolin-4-yl)thiocarbamoyl]benzamide Formula: C29H21N3O4S MolecularWeight: 507.55974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=CC4=C3C(=O)N(C4=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=CC4=C3C(=O)N(C4=O)C5=CC=CC=C5

InChI

InChI=1S/C29H21N3O4S/c33-26(20-11-7-14-22(17-20)36-18-19-9-3-1-4-10-19)31-29(37)30-24-16-8-15-23-25(24)28(35)32(27(23)34)21-12-5-2-6-13-21/h1-17H,18H2,(H2,30,31,33,37)